From ceaf20a21f6870dfc57a4b49b13b2212f4cc9329 Mon Sep 17 00:00:00 2001 From: Shettland Date: Tue, 17 Sep 2024 15:57:39 +0200 Subject: [PATCH 01/83] deleted deprecated auto-release --- .github/workflows/pypi_publish.yml | 39 ------------------------------ 1 file changed, 39 deletions(-) diff --git a/.github/workflows/pypi_publish.yml b/.github/workflows/pypi_publish.yml index 871b7235..68880657 100644 --- a/.github/workflows/pypi_publish.yml +++ b/.github/workflows/pypi_publish.yml @@ -47,42 +47,3 @@ jobs: path: dist/ - name: Publish to PyPI uses: pypa/gh-action-pypi-publish@release/v1 - - github-release: - name: Sign dist with Sigstore and upload to GitHub Release - needs: - - publish-to-pypi - runs-on: ubuntu-latest - permissions: - contents: write - id-token: write - steps: - - name: Download all the dists - uses: actions/download-artifact@v4 - with: - name: python-package-distributions - path: dist/ - - name: Sign the dists with Sigstore - uses: sigstore/gh-action-sigstore-python@v2.1.1 - with: - inputs: >- - ./dist/*.tar.gz - ./dist/*.whl - - name: Create GitHub Release - env: - GITHUB_TOKEN: ${{ github.token }} - run: >- - gh release create - '${{ github.ref_name }}' - --repo '${{ github.repository }}' - --notes "" - - name: Upload artifact signatures to GitHub Release - env: - GITHUB_TOKEN: ${{ github.token }} - # Upload to GitHub Release using the `gh` CLI. - # `dist/` contains the built packages, and the - # sigstore-produced signatures and certificates. - run: >- - gh release upload - '${{ github.ref_name }}' dist/** - --repo '${{ github.repository }}' \ No newline at end of file From e3dac35d06c1408fdf51caadede4f86c1177de6d Mon Sep 17 00:00:00 2001 From: Shettland Date: Tue, 17 Sep 2024 15:58:02 +0200 Subject: [PATCH 02/83] Removed duplicated tests with pushes after PR --- .github/workflows/test_sftp_handle.yml | 2 -- 1 file changed, 2 deletions(-) diff --git a/.github/workflows/test_sftp_handle.yml b/.github/workflows/test_sftp_handle.yml index a43a670f..4dd0364d 100644 --- a/.github/workflows/test_sftp_handle.yml +++ b/.github/workflows/test_sftp_handle.yml @@ -1,8 +1,6 @@ name: test_sftp_handle on: - push: - branches: "**" pull_request_target: types: [opened, reopened, synchronize, closed] branches: "**" From 15857e6ede32364d18d17455c87aff17179f8c0e Mon Sep 17 00:00:00 2001 From: Shettland Date: Tue, 17 Sep 2024 16:02:24 +0200 Subject: [PATCH 03/83] Updated CHANGELOG with actions fixes --- CHANGELOG.md | 5 ++++- 1 file changed, 4 insertions(+), 1 deletion(-) diff --git a/CHANGELOG.md b/CHANGELOG.md index 3c719d95..e6d70f45 100755 --- a/CHANGELOG.md +++ b/CHANGELOG.md @@ -4,7 +4,7 @@ All notable changes to this project will be documented in this file. The format is based on [Keep a Changelog](https://keepachangelog.com/en/1.0.0/), and this project adheres to [Semantic Versioning](https://semver.org/spec/v2.0.0.html). -## [1.X.Xdev] - 2024-XX-XX : https://github.com/BU-ISCIII/relecov-tools/releases/tag/1.X.X +## [1.2.0dev] - 2024-XX-XX : https://github.com/BU-ISCIII/relecov-tools/releases/tag/1.2.0 ### Credits @@ -20,6 +20,9 @@ Code contributions to the hotfix: #### Removed +- Removed duplicated tests with pushes after PR was merged in test_sftp-handle [#312](https://github.com/BU-ISCIII/relecov-tools/pull/312) +- Deleted deprecated auto-release in pypi_publish as it does not work with tag pushes anymore [#312](https://github.com/BU-ISCIII/relecov-tools/pull/312) + ### Requirements ## [1.1.0] - 2024-09-13 : https://github.com/BU-ISCIII/relecov-tools/releases/tag/1.1.0 From 479a5c2d9f94b5c40bb20b0619c21c8d51c922d8 Mon Sep 17 00:00:00 2001 From: Shettland Date: Wed, 18 Sep 2024 17:38:57 +0200 Subject: [PATCH 04/83] Introduced a decorator to reconnect when conection is lost --- relecov_tools/sftp_client.py | 41 ++++++++++++++++++++++++++++++++---- 1 file changed, 37 insertions(+), 4 deletions(-) diff --git a/relecov_tools/sftp_client.py b/relecov_tools/sftp_client.py index d9de82ca..b44f3c27 100644 --- a/relecov_tools/sftp_client.py +++ b/relecov_tools/sftp_client.py @@ -4,6 +4,7 @@ import rich.console import stat import sys +import time from relecov_tools.config_json import ConfigJson import relecov_tools.utils @@ -58,6 +59,28 @@ def __init__(self, conf_file=None, username=None, password=None): self.client = paramiko.SSHClient() self.client.set_missing_host_key_policy(paramiko.AutoAddPolicy()) + def reconnect_if_fail(n_times, sleep_time): + def decorator(func): + def retrier(self, *args, **kwargs): + more_sleep_time = sleep_time + retries = 0 + while retries < n_times: + try: + return func(self, *args, **kwargs) + except Exception: + retries += 1 + log.info("Connection lost. Trying to reconnect...") + time.sleep(more_sleep_time) + # Try extending sleep time before reconnecting in each step + more_sleep_time = more_sleep_time + sleep_time + self.open_connection() + else: + log.error("Could not reconnect to remote client") + return func(self, *args, **kwargs) + return retrier + return decorator + + def open_connection(self): """Establishing sftp connection""" log.info("Setting credentials for SFTP connection with remote server") @@ -78,6 +101,7 @@ def open_connection(self): return False return True + @reconnect_if_fail(n_times=3, sleep_time=30) def list_remote_folders(self, folder_name, recursive=False): """Creates a directories list from the given client remote path @@ -90,7 +114,6 @@ def list_remote_folders(self, folder_name, recursive=False): """ log.info("Listing directories in %s", folder_name) directory_list = [] - self.open_connection() try: content_list = self.sftp.listdir_attr(folder_name) subfolders = any(stat.S_ISDIR(item.st_mode) for item in content_list) @@ -129,6 +152,7 @@ def recursive_list(folder_name): self.close_connection() return directory_list + @reconnect_if_fail(n_times=3, sleep_time=30) def get_file_list(self, folder_name): """Return a tuple with file name and directory path from remote @@ -148,6 +172,7 @@ def get_file_list(self, folder_name): ] return file_list + @reconnect_if_fail(n_times=3, sleep_time=30) def get_from_sftp(self, file, destination, exist_ok=False): """Download a file from remote sftp @@ -169,6 +194,7 @@ def get_from_sftp(self, file, destination, exist_ok=False): log.error("Unable to fetch file %s ", e) return False + @reconnect_if_fail(n_times=3, sleep_time=30) def make_dir(self, folder_name): """Create a new directory in remote sftp @@ -186,6 +212,7 @@ def make_dir(self, folder_name): stderr.print("[red]Directory already exists") return False + @reconnect_if_fail(n_times=3, sleep_time=30) def rename_file(self, old_name, new_name): """Rename a file in remote sftp @@ -199,11 +226,13 @@ def rename_file(self, old_name, new_name): try: self.sftp.rename(old_name, new_name) return True - except FileNotFoundError: - log.error("File %s not found", old_name) - stderr.print("[red]File not found") + except FileNotFoundError as e: + error_txt = f"Could not rename {old_name} to {new_name}: {e}" + log.error(error_txt) + stderr.print(f"[red]{error_txt}") return False + @reconnect_if_fail(n_times=3, sleep_time=30) def remove_file(self, file_name): """Remove a file from remote sftp @@ -221,6 +250,7 @@ def remove_file(self, file_name): stderr.print("[red]File not found") return False + @reconnect_if_fail(n_times=3, sleep_time=30) def remove_dir(self, folder_name): """Remove a directory from remote sftp @@ -238,6 +268,7 @@ def remove_dir(self, folder_name): stderr.print("[red]Directory not found") return False + @reconnect_if_fail(n_times=3, sleep_time=30) def upload_file(self, local_path, remote_file): """Upload a file to remote sftp @@ -256,11 +287,13 @@ def upload_file(self, local_path, remote_file): stderr.print("[red]File not found") return False + @reconnect_if_fail(n_times=3, sleep_time=30) def close_connection(self): log.info("Closing SFTP connection") try: self.sftp.close() except NameError: + log.warning("Could not close sftp connection") return False log.info("SFTP connection closed") return True From ea02b5e98800816ade9f9e043212f0224cad9044 Mon Sep 17 00:00:00 2001 From: Shettland Date: Wed, 18 Sep 2024 17:42:17 +0200 Subject: [PATCH 05/83] Moved cleaning process to end of workflow --- relecov_tools/download_manager.py | 62 +++++++++++++++++++++---------- 1 file changed, 42 insertions(+), 20 deletions(-) diff --git a/relecov_tools/download_manager.py b/relecov_tools/download_manager.py index df770f3a..252bdb72 100755 --- a/relecov_tools/download_manager.py +++ b/relecov_tools/download_manager.py @@ -131,6 +131,7 @@ def __init__( self.relecov_sftp = relecov_tools.sftp_client.SftpRelecov( conf_file, sftp_user, sftp_passwd ) + self.finished_folders = {} def create_local_folder(self, folder): """Create folder to download files in local path using date @@ -267,7 +268,8 @@ def create_files_with_metadata_info( data = {k: v for k, v in data.items() if k not in samples_to_delete} with open(sample_data_path, "w", encoding="utf-8") as fh: fh.write(json.dumps(data, indent=4, sort_keys=True, ensure_ascii=False)) - log.info("Successfully created json file with samples %s", sample_data_path) + # Feed accessible dict with necessary information for wrapper to work + log.info("Successfully created samples json file %s", sample_data_path) return def remove_duplicated_values(self, sample_file_dict): @@ -574,7 +576,7 @@ def delete_remote_files(self, remote_folder, files=None, skip_seqs=False): if any(file.endswith(tuple(self.allowed_file_ext)) for file in files_to_remove): if skip_seqs is True: log_text = f"Folder {remote_folder} has sequencing files. Not removed." - self.include_warning(log_text) + log.warning(log_text) return for file in files_to_remove: try: @@ -583,11 +585,30 @@ def delete_remote_files(self, remote_folder, files=None, skip_seqs=False): ) log.info("%s Deleted from remote server", file) except (IOError, PermissionError) as e: - self.include_warning(f"Could not delete remote file {file}: {e}") + log.error(f"Could not delete remote file {file}: {e}") stderr.print(f"Could not delete remote file {file}. Error: {e}") return - def delete_remote_folder(self, remote_folder): + def rename_remote_folder(self, remote_folder): + if "tmp_processing" in remote_folder: + new_name = remote_folder.replace("tmp_processing", "invalid_samples") + try: + self.relecov_sftp.rename_file(remote_folder, new_name) + if self.finished_folders.get(remote_folder): + self.finished_folders[new_name] = self.finished_folders.pop( + remote_folder + ) + log.info("Successfully renamed %s to %s" % (remote_folder, new_name)) + except (OSError, PermissionError) as e: + log_text = f"Could not rename remote {remote_folder}. Error: {e}" + log.error(log_text) + else: + log.warning( + "No `tmp_processing` pattern in %s, not renamed" % remote_folder + ) + return + + def clean_remote_folder(self, remote_folder): """Delete a folder from remote sftp, check if it is empty or not first. Args: @@ -603,15 +624,16 @@ def remove_client_dir(remote_folder): log.info("Successfully removed %s", remote_folder) except (OSError, PermissionError) as e: log_text = f"Could not delete remote {remote_folder}. Error: {e}" - self.include_warning(log_text) + log.error(log_text) stderr.print(log_text) else: log.info("%s is a top-level folder. Not removed", remote_folder) remote_folder_files = self.relecov_sftp.get_file_list(remote_folder) if remote_folder_files: + self.rename_remote_folder(remote_folder) log_text = f"Remote folder {remote_folder} not empty. Not removed" - self.include_warning(log_text) + log.warning(log_text) else: remove_client_dir(remote_folder) return @@ -715,7 +737,7 @@ def md5_handler(md5sumlist, output_location): if not md5sumlist: error_text = "No md5sum could be found in remote folder %s" stderr.print(f"[yellow]{error_text % folder}") - self.include_warning(error_text) + self.include_warning(error_text % folder) continue folders_with_metadata[folder] = [fi for fi in files if fi not in md5sumlist] try: @@ -1006,7 +1028,7 @@ def process_filedict( processed(dict{str:str}): Updated valid_filedict """ processed_dict = {} - error_text = "md5 mismatch for %s" + error_text = "corrupted or md5 mismatch for %s" warning_text = "File %s not found in md5sum. Creating hash" for sample, vals in valid_filedict.items(): processed_dict[sample] = {} @@ -1028,13 +1050,12 @@ def process_filedict( del processed_dict[sample] return processed_dict - def download(self, target_folders, option="download"): + def download(self, target_folders): """Manages all the different functions to download files, verify their integrity and create initial json with filepaths and md5 hashes Args: target_folders (dict): dictionary - option (str, optional): Download option. Defaults to "download". """ log.info("Initiating download process") main_folder = self.platform_storage_folder @@ -1217,19 +1238,11 @@ def execute_process(self): for folder in processed_folders: self.current_folder = folder self.delete_remote_files(folder) - self.delete_remote_folder(folder) + self.clean_remote_folder(folder) stderr.print(f"Delete process finished in {folder}") else: target_folders, processed_folders = self.merge_subfolders(target_folders) - if self.download_option == "download_only": - self.download(target_folders, option="download") - if self.download_option == "download_clean": - self.download(target_folders, option="clean") - for folder in processed_folders: - self.current_folder = folder - self.delete_remote_files(folder, skip_seqs=True) - self.delete_remote_folder(folder) - stderr.print(f"Delete process finished in {folder}") + self.download(target_folders) self.relecov_sftp.close_connection() stderr.print(f"Processed {len(processed_folders)} folders: {processed_folders}") @@ -1238,5 +1251,14 @@ def execute_process(self): self.logsum.create_error_summary(called_module="download") else: log.info("Process log summary was empty. Not generated.") + # If download_option is "download_clean", remove + # sftp folder content after download is finished + if self.download_option == "download_clean": + folders_to_clean = copy.deepcopy(self.finished_folders) + for folder, downloaded_files in folders_to_clean.items(): + self.delete_remote_files(folder, files=downloaded_files) + self.delete_remote_files(folder, skip_seqs=True) + self.clean_remote_folder(folder) + stderr.print(f"Delete process finished in remote {folder}") stderr.print("Finished execution") return From 5133db8b17e0dd71d230c0f8f72f3efa8ec52553 Mon Sep 17 00:00:00 2001 From: Shettland Date: Wed, 18 Sep 2024 17:42:32 +0200 Subject: [PATCH 06/83] Now also check for gzip file integrity after download --- relecov_tools/download_manager.py | 26 +++++++++++++++----------- 1 file changed, 15 insertions(+), 11 deletions(-) diff --git a/relecov_tools/download_manager.py b/relecov_tools/download_manager.py index 252bdb72..3c0e00bb 100755 --- a/relecov_tools/download_manager.py +++ b/relecov_tools/download_manager.py @@ -5,6 +5,7 @@ import sys import os import yaml +import time import warnings import rich.console import paramiko @@ -1070,7 +1071,7 @@ def download(self, target_folders): # Close previously open connection to avoid timeouts try: self.relecov_sftp.close_connection() - except paramiko.ssh_exception.NoValidConnectionsError: + except paramiko.SSHException: pass # Check if the connection has been closed due to time limit self.relecov_sftp.open_connection() @@ -1161,10 +1162,13 @@ def download(self, target_folders): clean_fetchlist = [ fi for fi in fetched_files if fi.endswith(tuple(self.allowed_file_ext)) ] - clean_fetchlist = [fi for fi in clean_fetchlist if fi not in corrupted] # Checking for uncompressed files - files_to_compress = [fi for fi in clean_fetchlist if not fi.endswith(".gz")] + files_to_compress = [ + fi + for fi in clean_fetchlist + if not fi.endswith(".gz") and not fi.endswith(".bam") + ] if files_to_compress: comp_files = str(len(files_to_compress)) log.info("Found %s uncompressed files, compressing...", comp_files) @@ -1196,21 +1200,21 @@ def download(self, target_folders): relecov_tools.utils.calculate_md5(path) for path in clean_pathlist ] files_md5_dict = dict(zip(clean_fetchlist, md5_hashes)) - + for file in files_md5_dict.keys(): + full_f_path = os.path.join(local_folder, file) + if not relecov_tools.utils.check_gzip_integrity(full_f_path): + corrupted.append(file) + files_md5_dict.pop(file, None) processed_filedict = self.process_filedict( valid_filedict, clean_fetchlist, corrupted=corrupted, md5miss=not_md5sum ) self.create_files_with_metadata_info( local_folder, processed_filedict, files_md5_dict, meta_file ) - # If download_option is "download_clean", remove - # sftp folder content after download is finished - if option == "clean": - self.delete_remote_files(folder, files=files_to_download) - self.delete_remote_files(folder, skip_seqs=True) - self.delete_remote_folder(folder) - stderr.print(f"Delete process finished in remote {folder}") + if self.logsum.logs.get(self.current_folder): + self.logsum.logs[self.current_folder].update({"path": local_folder}) stderr.print(f"[green]Finished processing {folder}") + self.finished_folders[folder] = clean_fetchlist return def include_new_key(self, sample=None): From f818ae6089b388fd219e11da4bfab7cfdbff2821 Mon Sep 17 00:00:00 2001 From: Shettland Date: Wed, 18 Sep 2024 17:43:57 +0200 Subject: [PATCH 07/83] black linting --- relecov_tools/download_manager.py | 1 - relecov_tools/sftp_client.py | 3 ++- 2 files changed, 2 insertions(+), 2 deletions(-) diff --git a/relecov_tools/download_manager.py b/relecov_tools/download_manager.py index 3c0e00bb..89f4c8a5 100755 --- a/relecov_tools/download_manager.py +++ b/relecov_tools/download_manager.py @@ -5,7 +5,6 @@ import sys import os import yaml -import time import warnings import rich.console import paramiko diff --git a/relecov_tools/sftp_client.py b/relecov_tools/sftp_client.py index b44f3c27..0effba50 100644 --- a/relecov_tools/sftp_client.py +++ b/relecov_tools/sftp_client.py @@ -77,9 +77,10 @@ def retrier(self, *args, **kwargs): else: log.error("Could not reconnect to remote client") return func(self, *args, **kwargs) + return retrier - return decorator + return decorator def open_connection(self): """Establishing sftp connection""" From 8c7dfded0c57238f68a968d4f7705f312ff4a1a1 Mon Sep 17 00:00:00 2001 From: Shettland Date: Wed, 18 Sep 2024 17:47:30 +0200 Subject: [PATCH 08/83] Included changes in CHANGELOG.md --- CHANGELOG.md | 3 +++ 1 file changed, 3 insertions(+) diff --git a/CHANGELOG.md b/CHANGELOG.md index e6d70f45..4126fc4a 100755 --- a/CHANGELOG.md +++ b/CHANGELOG.md @@ -14,6 +14,9 @@ Code contributions to the hotfix: #### Added enhancements +- Now also check for gzip file integrity after download. Moved cleaning process to end of workflow [#313](https://github.com/BU-ISCIII/relecov-tools/pull/313) +- Introduced a decorator in sftp_client.py to reconnect when conection is lost [#313](https://github.com/BU-ISCIII/relecov-tools/pull/313) + #### Fixes #### Changed From 871fa4d6d56cae2c7a7aa74bcc408d3203d67c31 Mon Sep 17 00:00:00 2001 From: "juan.ledesma" Date: Thu, 19 Sep 2024 14:04:15 +0200 Subject: [PATCH 09/83] Included Hospital Universitario Araba among the hospitals in laboratory_address.json --- relecov_tools/conf/laboratory_address.json | 15 +++++++++++++-- 1 file changed, 13 insertions(+), 2 deletions(-) diff --git a/relecov_tools/conf/laboratory_address.json b/relecov_tools/conf/laboratory_address.json index 4acbf284..5b249689 100755 --- a/relecov_tools/conf/laboratory_address.json +++ b/relecov_tools/conf/laboratory_address.json @@ -972,13 +972,24 @@ "collecting_institution_address": " Jose Atxotegi Kalea, s/n", "collecting_institution_email": "", "geo_loc_state": "Pais Vasco", - "geo_loc_region": "Alava", - "geo_loc_city": "Gasteiz", + "geo_loc_region": "Gasteiz", + "geo_loc_city": "Alava", "geo_loc_country": "Spain", "submitting_institution": "Hospital Universitario Txagorritxu", "submitting_institution_address": " Jose Atxotegi Kalea, s/n", "submitting_institution_email": "" }, + "Hospital Universitario Araba": { + "collecting_institution_address": "Calle Jose Atxotegi, 01009", + "collecting_institution_email": "", + "geo_loc_state": "Pais Vasco", + "geo_loc_region": "Gasteiz", + "geo_loc_city": "Alava", + "geo_loc_country": "Spain", + "submitting_institution": "Hospital Universitario Donostia", + "submitting_institution_address": "Begiristain Doktorea Pasealekua, s/n", + "submitting_institution_email": "" + }, "Hospital Universitari Arnau de Vilanova": { "collecting_institution_address": "Av. Alcalde Rovira Roure, 80", "collecting_institution_email": "", From 3f530d6112bacba36ea05334c0ca8f4529a0606e Mon Sep 17 00:00:00 2001 From: "juan.ledesma" Date: Thu, 19 Sep 2024 15:29:07 +0200 Subject: [PATCH 10/83] Corrected geographical details on Hospital Universitario Araba --- relecov_tools/conf/laboratory_address.json | 8 ++++---- 1 file changed, 4 insertions(+), 4 deletions(-) diff --git a/relecov_tools/conf/laboratory_address.json b/relecov_tools/conf/laboratory_address.json index 5b249689..581c75d5 100755 --- a/relecov_tools/conf/laboratory_address.json +++ b/relecov_tools/conf/laboratory_address.json @@ -972,8 +972,8 @@ "collecting_institution_address": " Jose Atxotegi Kalea, s/n", "collecting_institution_email": "", "geo_loc_state": "Pais Vasco", - "geo_loc_region": "Gasteiz", - "geo_loc_city": "Alava", + "geo_loc_region": "Alava", + "geo_loc_city": "Gasteiz", "geo_loc_country": "Spain", "submitting_institution": "Hospital Universitario Txagorritxu", "submitting_institution_address": " Jose Atxotegi Kalea, s/n", @@ -983,8 +983,8 @@ "collecting_institution_address": "Calle Jose Atxotegi, 01009", "collecting_institution_email": "", "geo_loc_state": "Pais Vasco", - "geo_loc_region": "Gasteiz", - "geo_loc_city": "Alava", + "geo_loc_region": "Alava", + "geo_loc_city": "Gasteiz", "geo_loc_country": "Spain", "submitting_institution": "Hospital Universitario Donostia", "submitting_institution_address": "Begiristain Doktorea Pasealekua, s/n", From e4be6bdbe86acc695ee76dc446d7fc74bb422a1c Mon Sep 17 00:00:00 2001 From: "juan.ledesma" Date: Thu, 19 Sep 2024 15:41:25 +0200 Subject: [PATCH 11/83] Corrected geographical details on Hospital Universitario Araba --- CHANGELOG.md | 2 ++ 1 file changed, 2 insertions(+) diff --git a/CHANGELOG.md b/CHANGELOG.md index 4126fc4a..9bed050c 100755 --- a/CHANGELOG.md +++ b/CHANGELOG.md @@ -56,6 +56,7 @@ Code contributions to the hotfix: #### Changed - Changed pypi_publish action to publish on every release, no need to push tags [#308](https://github.com/BU-ISCIII/relecov-tools/pull/308) +- Included a new hospital (Hospital Universitario Araba) to laboratory_address.json [#315](https://github.com/BU-ISCIII/relecov-tools/pull/315) #### Removed @@ -77,3 +78,4 @@ Code contributions to the inital release: - [Erika Kvalem](https://github.com/ErikaKvalem) - [Alberto Lema](https://github.com/Alema91) - [Daniel Valle](https://github.com/Daniel-VM) +- [Juan Ledesma](https://github.com/juanledesma78) From b8bd9f1dd2606821bc7627a2123c80758de2e071 Mon Sep 17 00:00:00 2001 From: "juan.ledesma" Date: Thu, 19 Sep 2024 15:52:41 +0200 Subject: [PATCH 12/83] Updated CHANGELOG with changes in laboratory_address.json --- CHANGELOG.md | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/CHANGELOG.md b/CHANGELOG.md index 9bed050c..ba2a5b65 100755 --- a/CHANGELOG.md +++ b/CHANGELOG.md @@ -9,6 +9,7 @@ The format is based on [Keep a Changelog](https://keepachangelog.com/en/1.0.0/), ### Credits Code contributions to the hotfix: +- [Juan Ledesma](https://github.com/juanledesma78) ### Modules @@ -78,4 +79,3 @@ Code contributions to the inital release: - [Erika Kvalem](https://github.com/ErikaKvalem) - [Alberto Lema](https://github.com/Alema91) - [Daniel Valle](https://github.com/Daniel-VM) -- [Juan Ledesma](https://github.com/juanledesma78) From a41d65a1f626d533c5cf33e71ada70905522a692 Mon Sep 17 00:00:00 2001 From: OPSergio Date: Wed, 25 Sep 2024 12:21:40 +0200 Subject: [PATCH 13/83] =?UTF-8?q?A=C3=B1adido=20Hospital=20Universitari=20?= =?UTF-8?q?Doctor=20Josep=20Trueta?= MIME-Version: 1.0 Content-Type: text/plain; charset=UTF-8 Content-Transfer-Encoding: 8bit --- relecov_tools/conf/laboratory_address.json | 11 +++++++++++ 1 file changed, 11 insertions(+) diff --git a/relecov_tools/conf/laboratory_address.json b/relecov_tools/conf/laboratory_address.json index 581c75d5..45afe509 100755 --- a/relecov_tools/conf/laboratory_address.json +++ b/relecov_tools/conf/laboratory_address.json @@ -561,6 +561,17 @@ "submitting_institution_address": " Passeig de la Vall d'Hebron, 119-129", "submitting_institution_email": "" }, + "Hospital Universitari Doctor Josep Trueta": { + "collecting_institution_address": "Avinguda de França, S/N,", + "collecting_institution_email": "", + "geo_loc_state": "Cataluña", + "geo_loc_region": "Girona", + "geo_loc_city": "Girona", + "geo_loc_country": "Spain", + "submitting_institution": "Hospital Universitari Vall d'Hebron", + "submitting_institution_address": " Passeig de la Vall d'Hebron, 119-129", + "submitting_institution_email": "" + }, "Hospital Universitari Germans Trias i Pujol (HUGTiP)": { "collecting_institution_address": " Crta del Canyet s/n", "collecting_institution_email": "", From 8eab79a652057850522a1182e20452bd36b9a3a2 Mon Sep 17 00:00:00 2001 From: OPSergio Date: Wed, 25 Sep 2024 12:51:52 +0200 Subject: [PATCH 14/83] Add changes in CHANGELOG.md --- CHANGELOG.md | 1 + 1 file changed, 1 insertion(+) diff --git a/CHANGELOG.md b/CHANGELOG.md index ba2a5b65..c843aa1b 100755 --- a/CHANGELOG.md +++ b/CHANGELOG.md @@ -17,6 +17,7 @@ Code contributions to the hotfix: - Now also check for gzip file integrity after download. Moved cleaning process to end of workflow [#313](https://github.com/BU-ISCIII/relecov-tools/pull/313) - Introduced a decorator in sftp_client.py to reconnect when conection is lost [#313](https://github.com/BU-ISCIII/relecov-tools/pull/313) +- Add Hospital Universitari Doctor Josep Trueta to laboratory_address.json [#316] (https://github.com/BU-ISCIII/relecov-tools/pull/316) #### Fixes From 3a97cf274eb8c751c06ae6a80397323291c05ca8 Mon Sep 17 00:00:00 2001 From: Shettland Date: Thu, 19 Sep 2024 11:25:49 +0200 Subject: [PATCH 15/83] Included new fields for bioinformatics results --- relecov_tools/schema/relecov_schema.json | 51 +++++++++++++++++++----- 1 file changed, 40 insertions(+), 11 deletions(-) diff --git a/relecov_tools/schema/relecov_schema.json b/relecov_tools/schema/relecov_schema.json index 27b9bbe8..bc5b219c 100755 --- a/relecov_tools/schema/relecov_schema.json +++ b/relecov_tools/schema/relecov_schema.json @@ -1794,7 +1794,18 @@ "type": "string", "description": "number of base pairs per read", "classification": "Sequencing", - "label": "Read Length", + "label": "Read length", + "fill_mode": "batch" + }, + "number_of_reads" : { + "examples": [ + "75" + ], + "ontology": "GENEPIO:0000087", + "type": "string", + "description": "number of reads passing base call filters", + "classification": "Sequencing", + "label": "Read count", "fill_mode": "batch" }, "sequence_file_R1_fastq": { @@ -2346,7 +2357,7 @@ "type": "string", "description": "Percentage of read that pass quality control threshold ", "classification": "Bioinformatics and QC metrics fields", - "label": "%qc filtered", + "label": "%QC filtered", "fill_mode": "batch" }, "per_reads_host": { @@ -2357,7 +2368,7 @@ "type": "string", "description": "Percentage of reads mapped to host", "classification": "Bioinformatics and QC metrics fields", - "label": "%reads host", + "label": "%Reads host", "fill_mode": "batch" }, "per_reads_virus": { @@ -2368,7 +2379,7 @@ "type": "string", "description": "Percentage of reads mapped to virus", "classification": "Bioinformatics and QC metrics fields", - "label": "%reads virus", + "label": "%Reads virus", "fill_mode": "batch" }, "per_unmapped": { @@ -2379,7 +2390,7 @@ "type": "string", "description": "Percentage of reads unmapped to virus or to host", "classification": "Bioinformatics and QC metrics fields", - "label": "%unmapped", + "label": "%Unmapped", "fill_mode": "batch" }, "depth_of_coverage_value": { @@ -2390,7 +2401,7 @@ "type": "string", "description": "The average number of reads representing a given nucleotide in the reconstructed sequence.", "classification": "Bioinformatics and QC metrics fields", - "label": "Depth of coverage value ", + "label": "Depth of coverage Mean value", "fill_mode": "batch" }, "per_genome_greater_10x": { @@ -2401,7 +2412,7 @@ "type": "string", "description": "Percentage of genome with coverage greater than 10x", "classification": "Bioinformatics and QC metrics fields", - "label": "% genome greater 10x", + "label": "% Genome > 10x", "fill_mode": "batch" }, "per_Ns": { @@ -2434,7 +2445,7 @@ "type": "string", "description": "The number of variants found in consensus sequence", "classification": "Bioinformatic Variants", - "label": "Number of variants (AF greater 75%)", + "label": "Number of variants (AF > 75%)", "fill_mode": "batch" }, "number_of_variants_with_effect": { @@ -2467,7 +2478,7 @@ "type": "string", "description": "The name of the clade.", "classification": "Lineage fields", - "label": "Clade designation", + "label": "Variant Clade Genotype", "fill_mode": "batch" }, "clade_type_software_name": { @@ -2492,6 +2503,16 @@ "label": "If Clade/Type Is Other, Specify", "fill_mode": "batch" }, + "clade_type_software_version": { + "examples": [ + "Pangolin" + ], + "ontology": "GENEPIO:0001502", + "type": "string", + "description": "The version of the software used to determine the clade/type.", + "classification": "Lineage fields", + "label": "Clade/Type software version" + }, "lineage_analysis_software_name": { "examples": [ "Pangolin" @@ -2544,7 +2565,7 @@ "type": "string", "description": "The version of the scorpio data used to determine the lineage/clade.", "classification": "Lineage fields", - "label": "Lineage/clade analysis software version", + "label": "Scorpio version", "fill_mode": "batch" }, "lineage_analysis_constellation_version": { @@ -2555,7 +2576,7 @@ "type": "string", "description": "The version of the constellations databases used to determine the lineage/clade.", "classification": "Lineage fields", - "label": "Lineage/clade analysis software version", + "label": "Constellations version", "fill_mode": "batch" }, "lineage_analysis_date": { @@ -2570,6 +2591,14 @@ "label": "lineage/clade analysis date", "fill_mode": "batch" }, + "lineage_analysis_file": { + "ontology": "0", + "type": "string", + "description": "File containing results from lineage/clade analysis", + "classification": "Lineage fields", + "label": "Lineage analysis file", + "fill_mode": "batch" + }, "variant_name": { "ontology": "", "type": "string", From 473ef013029b550d054e43b1257b023347610f05 Mon Sep 17 00:00:00 2001 From: Shettland Date: Thu, 19 Sep 2024 12:12:41 +0200 Subject: [PATCH 16/83] Renamed bioinfo_heading field for alt_heading_equivalences --- relecov_tools/conf/configuration.json | 58 ++++++++++----------------- 1 file changed, 22 insertions(+), 36 deletions(-) diff --git a/relecov_tools/conf/configuration.json b/relecov_tools/conf/configuration.json index 724811e1..46b2efb9 100755 --- a/relecov_tools/conf/configuration.json +++ b/relecov_tools/conf/configuration.json @@ -56,42 +56,28 @@ "Sequence file R1 fastq", "Sequence file R2 fastq" ], - "bioinfo_heading": [ - "Consensus sequence filename", - "VCF filename", - "Variant designation table filename", - "Bioinformatics protocol", - "If bioinformatics protocol Is Other, Specify", - "Bioinformatics protocol version", - "Commercial/Open-source/both", - "Preprocessing software", - "Preprocessing software version", - "If preprocessing Is Other, Specify", - "Preprocessing params", - "Mapping software", - "Mapping software version", - "If mapping Is Other, Specify", - "Mapping params", - "Assembly software", - "Assembly software version", - "If assembly Is Other, Specify", - "Assembly params", - "Variant calling software", - "Variant calling software version", - "If variant calling Is Other, Specify", - "Variant calling params", - "Consensus software", - "Consensus software version", - "If consensus Is Other, Specify", - "Consensus params", - "Clade/Type identification software", - "Clade/Type software version", - "If Clade/Type Is Other, Specify", - "Lineage identification software", - "Lineage software version", - "If lineage identification Is Other, Specify", - "Quality control metrics (sample discard criteria)" - ], + "alt_heading_equivalences": { + "Sample ID": "Sample ID given for sequencing", + "LAB ID" : "Originating Laboratory", + "Sequencing date\n Formato: YYYY-MM-DD" : "Sequencing Date", + "Commercial All-in-one library kit" : "Commercial All-in-one library kit", + "Library preparation kit " : "Library Preparation Kit", + "Enrichment protocol" : "Enrichment Protocol", + "if enrichment protocol is Other, specify" : "If Enrichment Protocol Is Other, Specify", + "Amplicon protocol" : "Enrichment panel/assay", + "if enrichment panel/assay is Other, specify" : "If Enrichment panel/assay Is Other, Specify", + "Amplicon version" : "Enrichment panel/assay version", + "Number Of Samples In Run" : "Number Of Samples In Run", + "Number of variants with effect (missense, frameshit, stop codon)" : "Number of variants with effect", + "Sequencing platforms (Illumina, Nanopore, IonTorrent, PacBio, other)" : "Sequencing Instrument Model", + "Variant designation table filename" : "Lineage analysis file", + "Library preparation kit" : "Library Preparation Kit", + "Library layout" : "Library Layout", + "Variant Clade Genotype" : "clade_name", + "SARS-CoV-2 Lineage designation" : "Lineage designation", + "fastq filename R1" : "Sequence file R1 fastq", + "fastq filename R2" : "Sequence file R2 fastq" + }, "lab_metadata_req_json": { "laboratory_data": { "file": "laboratory_address.json", From bdf693142ff959e5d1d0cd077b3e8121b4430d6f Mon Sep 17 00:00:00 2001 From: Shettland Date: Thu, 19 Sep 2024 12:13:09 +0200 Subject: [PATCH 17/83] Included fields to support alternative header in metadata --- relecov_tools/conf/configuration.json | 6 +++++- 1 file changed, 5 insertions(+), 1 deletion(-) diff --git a/relecov_tools/conf/configuration.json b/relecov_tools/conf/configuration.json index 46b2efb9..97e257a4 100755 --- a/relecov_tools/conf/configuration.json +++ b/relecov_tools/conf/configuration.json @@ -226,8 +226,12 @@ "sftp_port": "22" }, "metadata_processing": { + "sample_id_col": "Sample ID given for sequencing", "header_flag": "CAMPO", - "excel_sheet": "METADATA_LAB" + "excel_sheet": "METADATA_LAB", + "alternative_sheet": "5.Viral Characterisation and Se", + "alternative_flag": "LAB ID", + "alternative_sample_id_col": "Sample ID" }, "abort_if_md5_mismatch": "False", "platform_storage_folder": "/tmp/relecov", From 2d4935d16ff35df81e3b9369e7be465bbb634946 Mon Sep 17 00:00:00 2001 From: Shettland Date: Thu, 19 Sep 2024 13:37:33 +0200 Subject: [PATCH 18/83] Updated alt_heading_equivalences new field --- relecov_tools/conf/configuration.json | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/relecov_tools/conf/configuration.json b/relecov_tools/conf/configuration.json index 97e257a4..af2081e4 100755 --- a/relecov_tools/conf/configuration.json +++ b/relecov_tools/conf/configuration.json @@ -73,7 +73,7 @@ "Variant designation table filename" : "Lineage analysis file", "Library preparation kit" : "Library Preparation Kit", "Library layout" : "Library Layout", - "Variant Clade Genotype" : "clade_name", + "Read lenght" : "Read length", "SARS-CoV-2 Lineage designation" : "Lineage designation", "fastq filename R1" : "Sequence file R1 fastq", "fastq filename R2" : "Sequence file R2 fastq" From db7765fb796a78491928d4133939f8c3c5586445 Mon Sep 17 00:00:00 2001 From: Shettland Date: Thu, 19 Sep 2024 13:38:36 +0200 Subject: [PATCH 19/83] Introduced a function to parse excel date back to numeric --- relecov_tools/utils.py | 6 ++++++ 1 file changed, 6 insertions(+) diff --git a/relecov_tools/utils.py b/relecov_tools/utils.py index 0636e4fb..c3ef2c8e 100755 --- a/relecov_tools/utils.py +++ b/relecov_tools/utils.py @@ -91,6 +91,12 @@ def read_excel_file(f_name, sheet_name, header_flag, leave_empty=True): return ws_data, heading_row +def excel_date_to_num(date): + """Transform a date object formatted by excel to a numeric value""" + try: + return date.toordinal() - datetime(1899,12,30).toordinal() + except AttributeError: + return None def read_csv_file_return_dict(file_name, sep=None, key_position=None): """Read csv or tsv file, according to separator, and return a dictionary From e52964942ebc9f18530ac9cdb743aadb2167e954 Mon Sep 17 00:00:00 2001 From: Shettland Date: Thu, 19 Sep 2024 13:50:08 +0200 Subject: [PATCH 20/83] samples_data file is no longer a mandatory input --- relecov_tools/read_lab_metadata.py | 87 +++++++++++++++++++++++++----- 1 file changed, 75 insertions(+), 12 deletions(-) diff --git a/relecov_tools/read_lab_metadata.py b/relecov_tools/read_lab_metadata.py index 2d4efbda..12e4d6a2 100755 --- a/relecov_tools/read_lab_metadata.py +++ b/relecov_tools/read_lab_metadata.py @@ -37,18 +37,15 @@ def __init__(self, metadata_file=None, sample_list_file=None, output_folder=None sys.exit(1) if sample_list_file is None: - self.sample_list_file = relecov_tools.utils.prompt_path( - msg="Select the file which contains the sample information" - ) - else: + stderr.print("[Yellow]No samples_data.json file provided") self.sample_list_file = sample_list_file - if not os.path.exists(self.sample_list_file): + if sample_list_file is not None and not os.path.exists(sample_list_file): log.error( - "Sample information file %s does not exist ", self.sample_list_file + "Sample information file %s does not exist ", sample_list_file ) stderr.print( - "[red] Sample information " + self.sample_list_file + " does not exist" + "[red] Samples file " + sample_list_file + " does not exist" ) sys.exit(1) @@ -97,6 +94,64 @@ def __init__(self, metadata_file=None, sample_list_file=None, output_folder=None "lab_metadata", "samples_json_fields" ) + def get_samples_files_data(self, clean_metadata_rows): + """Include the fields that would be included in samples_data.json + + Args: + clean_metadata_rows (list(dict)): Cleaned list of rows from metadata_lab.xlsx file + + Returns: + j_data (dict(dict)): Dictionary where each key is the sample ID and the values are + its file names, locations and md5 + """ + def safely_calculate_md5(file): + """Check file md5, but return Not Provided if file does not exist""" + try: + return relecov_tools.utils.calculate_md5(file) + except IOError: + return "Not Provided [GENEPIO:0001668]" + dir_path = os.path.dirname(os.path.realpath(self.metadata_file)) + md5_checksum_files = [f for f in os.listdir(dir_path) if "md5" in f] + if md5_checksum_files: + skip_list = self.configuration.get_topic_data("sftp_handle", "skip_when_found") + md5_dict = relecov_tools.utils.read_md5_checksum( + file_name=md5_checksum_files[0], avoid_chars=skip_list + ) + else: + md5_dict = {} + j_data = {} + no_fastq_error = "No R1 fastq was given for sample %s" + for sample in clean_metadata_rows: + files_dict = {} + r1_file = sample.get("sequence_file_R1_fastq") + r2_file = sample.get("sequence_file_R2_fastq") + if not r1_file: + self.logsum.add_error( + sample=sample.get("sequencing_sample_id"), + entry=no_fastq_error % sample.get("sequencing_sample_id") + ) + j_data[str(sample.get("sequencing_sample_id"))] = files_dict + continue + r1_md5 = md5_dict.get(r1_file) + r2_md5 = md5_dict.get(r2_file) + files_dict["r1_fastq_filepath"] = dir_path + if r1_md5: + files_dict["fastq_r1_md5"] = r1_md5 + else: + files_dict["fastq_r1_md5"] = safely_calculate_md5( + os.path.join(dir_path, r1_file) + ) + if r2_file: + files_dict["r2_fastq_filepath"] = dir_path + if r2_md5: + files_dict["fastq_r2_md5"] = r2_md5 + else: + files_dict["fastq_r2_md5"] = safely_calculate_md5( + os.path.join(dir_path, r2_file) + ) + j_data[str(sample.get("sequencing_sample_id"))] = files_dict + return j_data + def match_to_json(self, valid_metadata_rows): """Keep only the rows from samples present in the input file samples.json @@ -104,12 +159,17 @@ def match_to_json(self, valid_metadata_rows): valid_metadata_rows (list(dict)): List of rows from metadata_lab.xlsx file Returns: - clean_metadata_rows(list(dict)): _description_ - missing_samples(list(str)): + clean_metadata_rows(list(dict)): List of rows matching the samples in samples_data.json + missing_samples(list(str)): List of samples not found in samples_data.json """ - samples_json = relecov_tools.utils.read_json_file(self.sample_list_file) - clean_metadata_rows = [] missing_samples = [] + if not self.sample_list_file: + logtxt = "samples_data.json not provided, all samples will be included" + self.logsum.add_warning(entry=logtxt) + return valid_metadata_rows, missing_samples + else: + samples_json = relecov_tools.utils.read_json_file(self.sample_list_file) + clean_metadata_rows = [] for row in valid_metadata_rows: sample_id = str(row["sequencing_sample_id"]).strip() self.logsum.feed_key(sample=sample_id) @@ -251,7 +311,10 @@ def adding_fields(self, metadata): # TODO: Change sequencing_sample_id for some unique ID used in RELECOV database s_json["map_field"] = "sequencing_sample_id" s_json["adding_fields"] = self.samples_json_fields - s_json["j_data"] = relecov_tools.utils.read_json_file(self.sample_list_file) + if self.sample_list_file: + s_json["j_data"] = relecov_tools.utils.read_json_file(self.sample_list_file) + else: + s_json["j_data"] = self.get_samples_files_data(metadata) metadata = self.process_from_json(metadata, s_json) stderr.print("[green]Processed sample data file.") return metadata From e41be35628d552f3077adbd68185ab5d713c44f9 Mon Sep 17 00:00:00 2001 From: Shettland Date: Thu, 19 Sep 2024 13:52:15 +0200 Subject: [PATCH 21/83] Included a handling of alternative column names, also handled unexpected date cells --- relecov_tools/read_lab_metadata.py | 36 ++++++++++++++++++++++++++---- 1 file changed, 32 insertions(+), 4 deletions(-) diff --git a/relecov_tools/read_lab_metadata.py b/relecov_tools/read_lab_metadata.py index 12e4d6a2..d5980bf6 100755 --- a/relecov_tools/read_lab_metadata.py +++ b/relecov_tools/read_lab_metadata.py @@ -338,8 +338,24 @@ def read_metadata_file(self): """ meta_sheet = self.metadata_processing.get("excel_sheet") header_flag = self.metadata_processing.get("header_flag") - ws_metadata_lab, heading_row_number = relecov_tools.utils.read_excel_file( - self.metadata_file, meta_sheet, header_flag, leave_empty=False + sample_id_col = self.metadata_processing.get("sample_id_col") + self.alternative_heading = False + try: + ws_metadata_lab, heading_row_number = relecov_tools.utils.read_excel_file( + self.metadata_file, meta_sheet, header_flag, leave_empty=False + ) + except KeyError: + self.alternative_heading = True + alt_sheet = self.metadata_processing.get("alternative_sheet") + header_flag = self.metadata_processing.get("alternative_flag") + sample_id_col = self.metadata_processing.get("alternative_sample_id_col") + logtxt = f"No excel sheet named {meta_sheet}. Using {alt_sheet}" + stderr.print(f"[yellow]{logtxt}") + ws_metadata_lab, heading_row_number = relecov_tools.utils.read_excel_file( + self.metadata_file, alt_sheet, header_flag, leave_empty=False + ) + alt_header_dict = self.configuration.get_topic_data( + "lab_metadata", "alt_heading_equivalences" ) valid_metadata_rows = [] row_number = heading_row_number @@ -347,7 +363,7 @@ def read_metadata_file(self): row_number += 1 property_row = {} try: - sample_id = str(row["Sample ID given for sequencing"]).strip() + sample_id = str(row[sample_id_col]).strip() except KeyError: log_text = f"Sample ID given for sequencing empty in row {row_number}" log.error(log_text) @@ -384,16 +400,28 @@ def read_metadata_file(self): else: if isinstance(row[key], float) or isinstance(row[key], int): row[key] = str(row[key]) + if not "date" in key.lower() and isinstance(row[key], dtime): + logtxt = f"Non-date field {key} provided as date. Parsed as int" + self.logsum.add_warning(sample=sample_id, entry=logtxt) + row[key] = str(relecov_tools.utils.excel_date_to_num(row[key])) + if self.alternative_heading: + alt_key = alt_header_dict.get(key) if row[key] is not None or "not provided" not in str(row[key]).lower(): try: property_row[self.label_prop_dict[key]] = row[key] except KeyError as e: + if self.alternative_heading: + try: + property_row[self.label_prop_dict[alt_key]] = row[key] + continue + except KeyError: + pass log_text = f"Error when mapping the label {str(e)}" self.logsum.add_error(sample=sample_id, entry=log_text) stderr.print(f"[red]{log_text}") continue - valid_metadata_rows.append(property_row) + return valid_metadata_rows def create_metadata_json(self): From 339cc6711f9939b42992f9f68720424f25e02019 Mon Sep 17 00:00:00 2001 From: Shettland Date: Thu, 19 Sep 2024 13:53:05 +0200 Subject: [PATCH 22/83] samples_data file no longer mandatory, handling alternative column names --- relecov_tools/read_lab_metadata.py | 22 +++++++++++----------- 1 file changed, 11 insertions(+), 11 deletions(-) diff --git a/relecov_tools/read_lab_metadata.py b/relecov_tools/read_lab_metadata.py index d5980bf6..27924201 100755 --- a/relecov_tools/read_lab_metadata.py +++ b/relecov_tools/read_lab_metadata.py @@ -41,12 +41,8 @@ def __init__(self, metadata_file=None, sample_list_file=None, output_folder=None self.sample_list_file = sample_list_file if sample_list_file is not None and not os.path.exists(sample_list_file): - log.error( - "Sample information file %s does not exist ", sample_list_file - ) - stderr.print( - "[red] Samples file " + sample_list_file + " does not exist" - ) + log.error("Sample information file %s does not exist ", sample_list_file) + stderr.print("[red] Samples file " + sample_list_file + " does not exist") sys.exit(1) if output_folder is None: @@ -104,16 +100,20 @@ def get_samples_files_data(self, clean_metadata_rows): j_data (dict(dict)): Dictionary where each key is the sample ID and the values are its file names, locations and md5 """ + def safely_calculate_md5(file): """Check file md5, but return Not Provided if file does not exist""" try: return relecov_tools.utils.calculate_md5(file) except IOError: return "Not Provided [GENEPIO:0001668]" + dir_path = os.path.dirname(os.path.realpath(self.metadata_file)) md5_checksum_files = [f for f in os.listdir(dir_path) if "md5" in f] if md5_checksum_files: - skip_list = self.configuration.get_topic_data("sftp_handle", "skip_when_found") + skip_list = self.configuration.get_topic_data( + "sftp_handle", "skip_when_found" + ) md5_dict = relecov_tools.utils.read_md5_checksum( file_name=md5_checksum_files[0], avoid_chars=skip_list ) @@ -128,7 +128,7 @@ def safely_calculate_md5(file): if not r1_file: self.logsum.add_error( sample=sample.get("sequencing_sample_id"), - entry=no_fastq_error % sample.get("sequencing_sample_id") + entry=no_fastq_error % sample.get("sequencing_sample_id"), ) j_data[str(sample.get("sequencing_sample_id"))] = files_dict continue @@ -147,8 +147,8 @@ def safely_calculate_md5(file): files_dict["fastq_r2_md5"] = r2_md5 else: files_dict["fastq_r2_md5"] = safely_calculate_md5( - os.path.join(dir_path, r2_file) - ) + os.path.join(dir_path, r2_file) + ) j_data[str(sample.get("sequencing_sample_id"))] = files_dict return j_data @@ -404,7 +404,7 @@ def read_metadata_file(self): logtxt = f"Non-date field {key} provided as date. Parsed as int" self.logsum.add_warning(sample=sample_id, entry=logtxt) row[key] = str(relecov_tools.utils.excel_date_to_num(row[key])) - if self.alternative_heading: + if self.alternative_heading: alt_key = alt_header_dict.get(key) if row[key] is not None or "not provided" not in str(row[key]).lower(): try: From 4b093d36ab041ae46d9d7a462464854273e199f5 Mon Sep 17 00:00:00 2001 From: Shettland Date: Thu, 19 Sep 2024 14:05:44 +0200 Subject: [PATCH 23/83] Updated CHANGELOG --- CHANGELOG.md | 5 +++++ 1 file changed, 5 insertions(+) diff --git a/CHANGELOG.md b/CHANGELOG.md index c843aa1b..3e8717fe 100755 --- a/CHANGELOG.md +++ b/CHANGELOG.md @@ -18,11 +18,16 @@ Code contributions to the hotfix: - Now also check for gzip file integrity after download. Moved cleaning process to end of workflow [#313](https://github.com/BU-ISCIII/relecov-tools/pull/313) - Introduced a decorator in sftp_client.py to reconnect when conection is lost [#313](https://github.com/BU-ISCIII/relecov-tools/pull/313) - Add Hospital Universitari Doctor Josep Trueta to laboratory_address.json [#316] (https://github.com/BU-ISCIII/relecov-tools/pull/316) +- samples_data json file is no longer mandatory as input in read-lab-metadata [#314](https://github.com/BU-ISCIII/relecov-tools/pull/314) +- Included handling of alternative column names to support two distinct headers using the same schema in read-lab-metadata [#314](https://github.com/BU-ISCIII/relecov-tools/pull/314) #### Fixes #### Changed +- Renamed and refactored "bioinfo_lab_heading" for "alt_header_equivalences" in configuration.json [#314](https://github.com/BU-ISCIII/relecov-tools/pull/314) +- Included a few schema fields that were missing or outdated, related to bioinformatics results [#314](https://github.com/BU-ISCIII/relecov-tools/pull/314) + #### Removed - Removed duplicated tests with pushes after PR was merged in test_sftp-handle [#312](https://github.com/BU-ISCIII/relecov-tools/pull/312) From 56bb2f155492aa3751feabd486d0ec35234ea01b Mon Sep 17 00:00:00 2001 From: Shettland Date: Thu, 19 Sep 2024 14:07:32 +0200 Subject: [PATCH 24/83] Updated read-lab-metadata. Linting --- relecov_tools/read_lab_metadata.py | 2 +- relecov_tools/utils.py | 4 +++- 2 files changed, 4 insertions(+), 2 deletions(-) diff --git a/relecov_tools/read_lab_metadata.py b/relecov_tools/read_lab_metadata.py index 27924201..810ac3d0 100755 --- a/relecov_tools/read_lab_metadata.py +++ b/relecov_tools/read_lab_metadata.py @@ -400,7 +400,7 @@ def read_metadata_file(self): else: if isinstance(row[key], float) or isinstance(row[key], int): row[key] = str(row[key]) - if not "date" in key.lower() and isinstance(row[key], dtime): + if "date" not in key.lower() and isinstance(row[key], dtime): logtxt = f"Non-date field {key} provided as date. Parsed as int" self.logsum.add_warning(sample=sample_id, entry=logtxt) row[key] = str(relecov_tools.utils.excel_date_to_num(row[key])) diff --git a/relecov_tools/utils.py b/relecov_tools/utils.py index c3ef2c8e..90af3d5f 100755 --- a/relecov_tools/utils.py +++ b/relecov_tools/utils.py @@ -91,13 +91,15 @@ def read_excel_file(f_name, sheet_name, header_flag, leave_empty=True): return ws_data, heading_row + def excel_date_to_num(date): """Transform a date object formatted by excel to a numeric value""" try: - return date.toordinal() - datetime(1899,12,30).toordinal() + return date.toordinal() - datetime(1899, 12, 30).toordinal() except AttributeError: return None + def read_csv_file_return_dict(file_name, sep=None, key_position=None): """Read csv or tsv file, according to separator, and return a dictionary where the main key is the first column, if key position is None otherwise From e42a7927bb8f9a47fab860166df488cfe6d6030c Mon Sep 17 00:00:00 2001 From: Shettland Date: Thu, 19 Sep 2024 14:11:50 +0200 Subject: [PATCH 25/83] Updated read-lab-metadata. Linting2 --- relecov_tools/read_lab_metadata.py | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/relecov_tools/read_lab_metadata.py b/relecov_tools/read_lab_metadata.py index 810ac3d0..3431c189 100755 --- a/relecov_tools/read_lab_metadata.py +++ b/relecov_tools/read_lab_metadata.py @@ -38,7 +38,7 @@ def __init__(self, metadata_file=None, sample_list_file=None, output_folder=None if sample_list_file is None: stderr.print("[Yellow]No samples_data.json file provided") - self.sample_list_file = sample_list_file + self.sample_list_file = sample_list_file if sample_list_file is not None and not os.path.exists(sample_list_file): log.error("Sample information file %s does not exist ", sample_list_file) From b14910df8a397bcba04a19232d3cdc54b48bf105 Mon Sep 17 00:00:00 2001 From: Shettland Date: Thu, 19 Sep 2024 15:38:18 +0200 Subject: [PATCH 26/83] Updated relecov_schema version --- relecov_tools/schema/relecov_schema.json | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/relecov_tools/schema/relecov_schema.json b/relecov_tools/schema/relecov_schema.json index bc5b219c..bc605d45 100755 --- a/relecov_tools/schema/relecov_schema.json +++ b/relecov_tools/schema/relecov_schema.json @@ -3,7 +3,7 @@ "id": "https://github.com/BU-ISCIII/relecov-tools/blob/develop/relecov_tools/schema/relecov_schema.json", "title": "RELECOV schema", "description":"Json schema that specifies the structure, content, and validation rules for RELECOV metadata", - "version": "2.0.0", + "version": "2.1.0", "required": [ "collecting_lab_sample_id", "sequencing_sample_id", From 6fed93414d6396dac88c52e5ba9d5e56efd67d78 Mon Sep 17 00:00:00 2001 From: Shettland Date: Fri, 20 Sep 2024 12:54:53 +0200 Subject: [PATCH 27/83] merged changes --- CHANGELOG.md | 4 ++-- 1 file changed, 2 insertions(+), 2 deletions(-) diff --git a/CHANGELOG.md b/CHANGELOG.md index 3e8717fe..ce3a4816 100755 --- a/CHANGELOG.md +++ b/CHANGELOG.md @@ -4,7 +4,7 @@ All notable changes to this project will be documented in this file. The format is based on [Keep a Changelog](https://keepachangelog.com/en/1.0.0/), and this project adheres to [Semantic Versioning](https://semver.org/spec/v2.0.0.html). -## [1.2.0dev] - 2024-XX-XX : https://github.com/BU-ISCIII/relecov-tools/releases/tag/1.2.0 +## [1.2.0] - 2024-09-19 : https://github.com/BU-ISCIII/relecov-tools/releases/tag/1.2.0 ### Credits @@ -39,7 +39,7 @@ Code contributions to the hotfix: ### Credits -Code contributions to the hotfix: +Code contributions to the release: - [Pablo Mata](https://github.com/Shettland) - [Sara Monzón](https://github.com/saramonzon) From bfdc63c4a6d34932b5ff75916e818cc27caac314 Mon Sep 17 00:00:00 2001 From: Shettland Date: Fri, 20 Sep 2024 12:56:14 +0200 Subject: [PATCH 28/83] changelog hotfix --- CHANGELOG.md | 8 +++++--- 1 file changed, 5 insertions(+), 3 deletions(-) diff --git a/CHANGELOG.md b/CHANGELOG.md index ce3a4816..12cfec88 100755 --- a/CHANGELOG.md +++ b/CHANGELOG.md @@ -4,12 +4,14 @@ All notable changes to this project will be documented in this file. The format is based on [Keep a Changelog](https://keepachangelog.com/en/1.0.0/), and this project adheres to [Semantic Versioning](https://semver.org/spec/v2.0.0.html). -## [1.2.0] - 2024-09-19 : https://github.com/BU-ISCIII/relecov-tools/releases/tag/1.2.0 +## [1.2.0] - 2024-09-XX : https://github.com/BU-ISCIII/relecov-tools/releases/tag/1.2.0 ### Credits -Code contributions to the hotfix: +Code contributions to the release: + - [Juan Ledesma](https://github.com/juanledesma78) +- [Pablo Mata](https://github.com/Shettland) ### Modules @@ -20,6 +22,7 @@ Code contributions to the hotfix: - Add Hospital Universitari Doctor Josep Trueta to laboratory_address.json [#316] (https://github.com/BU-ISCIII/relecov-tools/pull/316) - samples_data json file is no longer mandatory as input in read-lab-metadata [#314](https://github.com/BU-ISCIII/relecov-tools/pull/314) - Included handling of alternative column names to support two distinct headers using the same schema in read-lab-metadata [#314](https://github.com/BU-ISCIII/relecov-tools/pull/314) +- Included a new hospital (Hospital Universitario Araba) to laboratory_address.json [#315](https://github.com/BU-ISCIII/relecov-tools/pull/315) #### Fixes @@ -63,7 +66,6 @@ Code contributions to the release: #### Changed - Changed pypi_publish action to publish on every release, no need to push tags [#308](https://github.com/BU-ISCIII/relecov-tools/pull/308) -- Included a new hospital (Hospital Universitario Araba) to laboratory_address.json [#315](https://github.com/BU-ISCIII/relecov-tools/pull/315) #### Removed From 581b331b552159878a4517c869cb071385bf48f2 Mon Sep 17 00:00:00 2001 From: Shettland Date: Wed, 25 Sep 2024 15:26:38 +0200 Subject: [PATCH 29/83] Updated2 CHANGELOG --- CHANGELOG.md | 1 + 1 file changed, 1 insertion(+) diff --git a/CHANGELOG.md b/CHANGELOG.md index 12cfec88..31e52f8f 100755 --- a/CHANGELOG.md +++ b/CHANGELOG.md @@ -12,6 +12,7 @@ Code contributions to the release: - [Juan Ledesma](https://github.com/juanledesma78) - [Pablo Mata](https://github.com/Shettland) +- [Sergio Olmos](https://github.com/OPSergio) ### Modules From def1ab34eb8acff38dd0ab82a452f77f76f5001f Mon Sep 17 00:00:00 2001 From: Shettland Date: Mon, 7 Oct 2024 12:32:43 +0200 Subject: [PATCH 30/83] Updated metadata excel template, moved to assets --- .../Relecov_metadata_template_v2.0.11.xlsx | Bin 0 -> 241013 bytes .../Relecov_metadata_template_v2.0.9.xlsx | Bin 241287 -> 0 bytes 2 files changed, 0 insertions(+), 0 deletions(-) create mode 100644 relecov_tools/assets/Relecov_metadata_template_v2.0.11.xlsx delete mode 100644 relecov_tools/templates/Relecov_metadata_template_v2.0.9.xlsx diff --git a/relecov_tools/assets/Relecov_metadata_template_v2.0.11.xlsx b/relecov_tools/assets/Relecov_metadata_template_v2.0.11.xlsx new file mode 100644 index 0000000000000000000000000000000000000000..0ebdda52556492cc71247bd20c695a8d65452287 GIT binary patch literal 241013 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R1C1FZ4@?^p&wx1&^k1bpIyL|R From c8a4e9ce627addeb77889c594231fbaa10c85dc7 Mon Sep 17 00:00:00 2001 From: Shettland Date: Mon, 7 Oct 2024 12:33:41 +0200 Subject: [PATCH 31/83] Now python lint only triggers when PR includes python files --- .github/workflows/python_lint.yml | 21 +++++++++++++++++++++ 1 file changed, 21 insertions(+) diff --git a/.github/workflows/python_lint.yml b/.github/workflows/python_lint.yml index 9d043bbd..45dbe4f3 100644 --- a/.github/workflows/python_lint.yml +++ b/.github/workflows/python_lint.yml @@ -21,8 +21,19 @@ jobs: uses: actions/checkout@master - name: Install flake8 run: pip install flake8 + - name: Check for Python file changes + id: file_check + uses: tj-actions/changed-files@v44 + with: + sha: ${{ github.event.pull_request.head.sha }} + files: | + **.py - name: Run flake8 + if: steps.file_check.outputs.any_changed == 'true' run: flake8 --ignore E501,W503,E203,W605 + - name: No Python files changed + if: steps.file_check.outputs.any_changed != 'true' + run: echo "No Python files have been changed." black_lint: runs-on: ubuntu-latest @@ -31,5 +42,15 @@ jobs: uses: actions/checkout@v2 - name: Install black in jupyter run: pip install black[jupyter] + - name: Check for Python file changes + id: file_check + uses: tj-actions/changed-files@v44 + with: + sha: ${{ github.event.pull_request.head.sha }} + files: '**.py' - name: Check code lints with Black + if: steps.file_check.outputs.any_changed == 'true' uses: psf/black@stable + - name: No Python files changed + if: steps.file_check.outputs.any_changed != 'true' + run: echo "No Python files have been changed." From 6c350399082b68896a51eea10f5ca7ee5dcf3e69 Mon Sep 17 00:00:00 2001 From: Shettland Date: Mon, 7 Oct 2024 12:41:20 +0200 Subject: [PATCH 32/83] Test to solve concurrency issues --- .github/workflows/test_sftp_handle.yml | 21 +++++++-------------- 1 file changed, 7 insertions(+), 14 deletions(-) diff --git a/.github/workflows/test_sftp_handle.yml b/.github/workflows/test_sftp_handle.yml index 4dd0364d..086d4d42 100644 --- a/.github/workflows/test_sftp_handle.yml +++ b/.github/workflows/test_sftp_handle.yml @@ -2,9 +2,13 @@ name: test_sftp_handle on: pull_request_target: - types: [opened, reopened, synchronize, closed] + types: [opened, reopened, synchronize] branches: "**" - + +concurrency: + group: ${{ github.repository }}-test_sftp_handle + cancel-in-progress: false + jobs: security_check: runs-on: ubuntu-latest @@ -22,21 +26,10 @@ jobs: echo "Current permission level is ${{ steps.checkAccess.outputs.user-permission }}" echo "Job originally triggered by ${{ github.actor }}" exit 1 - - sleep_to_ensure_concurrency: - needs: security_check - runs-on: ubuntu-latest - steps: - - name: - run: sleep 10s - shell: bash test_sftp_handle: - needs: [security_check, sleep_to_ensure_concurrency] + needs: security_check if: github.repository_owner == 'BU-ISCIII' - concurrency: - group: ${{ github.repository }}-test_sftp_handle - cancel-in-progress: false runs-on: ubuntu-latest strategy: max-parallel: 1 From 6628115b3aa224fca4ddcd55cf3ae26c12dc48f7 Mon Sep 17 00:00:00 2001 From: Shettland Date: Mon, 7 Oct 2024 12:42:19 +0200 Subject: [PATCH 33/83] Fixed wrong city name --- relecov_tools/conf/laboratory_address.json | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/relecov_tools/conf/laboratory_address.json b/relecov_tools/conf/laboratory_address.json index 45afe509..619352b5 100755 --- a/relecov_tools/conf/laboratory_address.json +++ b/relecov_tools/conf/laboratory_address.json @@ -1424,7 +1424,7 @@ "collecting_institution_email": "", "geo_loc_state": "Pais Vasco", "geo_loc_region": "Vizcaya", - "geo_loc_city": "Baracaldo", + "geo_loc_city": "Barakaldo", "geo_loc_country": "Spain", "submitting_institution": "Hospital Universitario Cruces", "submitting_institution_address": "Plaza Cruces, s/n", From c10a3319b5352047e0c84eda5b7fa101ec93544d Mon Sep 17 00:00:00 2001 From: Shettland Date: Mon, 7 Oct 2024 12:55:36 +0200 Subject: [PATCH 34/83] Updated md5sum file for test dataset1 --- tests/data/sftp_handle/datatest1/md5sum.txt | 24 ++++++++++----------- 1 file changed, 12 insertions(+), 12 deletions(-) mode change 100755 => 100644 tests/data/sftp_handle/datatest1/md5sum.txt diff --git a/tests/data/sftp_handle/datatest1/md5sum.txt b/tests/data/sftp_handle/datatest1/md5sum.txt old mode 100755 new mode 100644 index af658a0b..53d39c9b --- a/tests/data/sftp_handle/datatest1/md5sum.txt +++ b/tests/data/sftp_handle/datatest1/md5sum.txt @@ -1,12 +1,12 @@ -c1551cdf3d5e9849b80a082051907a72 SAMPLE1_R1.fastq.gz -449407f85d7ed4388b7d8a51e28d97a8 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0000000000000000000000000000000000000000..ce87295c6d164aa20fc01b934ebb37b5de8e0389 GIT binary patch literal 234 zcmVWRVCDkkvwYW&Q9#>eR)goeGIv(U_bIT&lj0bL*%RitmD&f zT^V)|eJb2$?&+2=;hB~J*UTaeM{o(R(8zF@Bx$+D!2$t?lQYFQ(rXe7kd?=j^@Rw= z!a70l6$la-?_z8_w&gF!)b76sJ;uBf+8sSYMrs8K&?7r$-{z~VZiS|mI@BwWgFnNC kOz67GqRWJhT2!~Pv}UadIE?NJ*KfCd041f!sxATm08+_n3jhEB literal 0 HcmV?d00001 From 23f74639317a400e232363a9bc3abe97a29a00cf Mon Sep 17 00:00:00 2001 From: Shettland Date: Mon, 7 Oct 2024 14:06:25 +0200 Subject: [PATCH 37/83] Updated CHANGELOG.md --- CHANGELOG.md | 7 +++++++ 1 file changed, 7 insertions(+) diff --git a/CHANGELOG.md b/CHANGELOG.md index 31e52f8f..113748e3 100755 --- a/CHANGELOG.md +++ b/CHANGELOG.md @@ -27,10 +27,17 @@ Code contributions to the release: #### Fixes +- Fixed wrong city name in relecov_tools/conf/laboratory_address.json [#320](https://github.com/BU-ISCIII/relecov-tools/pull/320) + #### Changed - Renamed and refactored "bioinfo_lab_heading" for "alt_header_equivalences" in configuration.json [#314](https://github.com/BU-ISCIII/relecov-tools/pull/314) - Included a few schema fields that were missing or outdated, related to bioinformatics results [#314](https://github.com/BU-ISCIII/relecov-tools/pull/314) +- Updated metadata excel template, moved to relecov_tools/assets [#320](https://github.com/BU-ISCIII/relecov-tools/pull/320) +- Now python lint only triggers when PR includes python files [#320](https://github.com/BU-ISCIII/relecov-tools/pull/320) +- Moved concurrency to whole workflow instead of each step in test_sftp-handle.yml [#320](https://github.com/BU-ISCIII/relecov-tools/pull/320) +- Updated test_sftp-handle.yml testing datasets [#320](https://github.com/BU-ISCIII/relecov-tools/pull/320) + #### Removed From 8eb3650226a448e7a4e7f0cbb4d9a0baa9e33bb8 Mon Sep 17 00:00:00 2001 From: Shettland Date: Mon, 7 Oct 2024 16:36:52 +0200 Subject: [PATCH 38/83] Now single logs summaries are also created for each folder --- relecov_tools/download_manager.py | 13 ++++++++++++- 1 file changed, 12 insertions(+), 1 deletion(-) diff --git a/relecov_tools/download_manager.py b/relecov_tools/download_manager.py index 89f4c8a5..37eac56e 100755 --- a/relecov_tools/download_manager.py +++ b/relecov_tools/download_manager.py @@ -1212,8 +1212,19 @@ def download(self, target_folders): ) if self.logsum.logs.get(self.current_folder): self.logsum.logs[self.current_folder].update({"path": local_folder}) + try: + folder_basename = os.path.basename(local_folder.rstrip("/")) + log_name = folder_basename + "_download_log_summary.json" + self.logsum.create_error_summary( + filepath=os.path.join(local_folder, log_name), + logs={ + self.current_folder: self.logsum.logs[self.current_folder] + }, + ) + except Exception as e: + log.error("Could not create logsum for %s: %s" % (folder, str(e))) stderr.print(f"[green]Finished processing {folder}") - self.finished_folders[folder] = clean_fetchlist + self.finished_folders[folder] = list(files_md5_dict.keys()) return def include_new_key(self, sample=None): From 134e6218fbacb27e1c5f1532b5e26c9d544d35c9 Mon Sep 17 00:00:00 2001 From: Shettland Date: Mon, 7 Oct 2024 16:38:55 +0200 Subject: [PATCH 39/83] Fixed wrong single-paired layout detection in metadata --- relecov_tools/download_manager.py | 10 ++++------ 1 file changed, 4 insertions(+), 6 deletions(-) diff --git a/relecov_tools/download_manager.py b/relecov_tools/download_manager.py index 37eac56e..3fab55f6 100755 --- a/relecov_tools/download_manager.py +++ b/relecov_tools/download_manager.py @@ -389,23 +389,22 @@ def get_sample_fastq_file_names(self, local_folder, meta_f_path): except ValueError as e: stderr.print("[red]Unable to convert to string. ", e) continue - if s_name not in sample_file_dict: - sample_file_dict[s_name] = {} - else: + if s_name in sample_file_dict: log_text = f"Found duplicated sample name: {s_name}. Skipped." stderr.print(log_text) self.include_warning(log_text, sample=s_name) continue - if row[index_layout] == "paired" and row[index_fastq_r2] is None: + if row[index_layout] == "Paired" and row[index_fastq_r2] is None: error_text = "Sample %s is paired-end, but no R2 given" self.include_error(error_text % str(row[index_sampleID]), s_name) row_complete = False - if row[index_layout] == "single" and row[index_fastq_r2] is not None: + if row[index_layout] == "Single" and row[index_fastq_r2] is not None: error_text = "Sample %s is single-end, but R1&R2 given" self.include_error(error_text % str(row[index_sampleID]), s_name) row_complete = False if row_complete: if row[index_fastq_r1] is not None: + sample_file_dict[s_name] = {} # TODO: move these keys to configuration.json sample_file_dict[s_name]["sequence_file_R1_fastq"] = row[ index_fastq_r1 @@ -418,7 +417,6 @@ def get_sample_fastq_file_names(self, local_folder, meta_f_path): log_text = "Fastq_R1 not defined in Metadata for sample %s" stderr.print(f"[red]{str(log_text % s_name)}") self.include_error(entry=str(log_text % s_name), sample=s_name) - del sample_file_dict[s_name] else: self.include_warning(entry=f"Row {counter} skipped. No sample ID given") # Remove duplicated files From 5f5ef8adec6021cb046bbe447bf2f4301ae821ce Mon Sep 17 00:00:00 2001 From: Shettland Date: Mon, 7 Oct 2024 16:40:46 +0200 Subject: [PATCH 40/83] More accurate cleaning process --- relecov_tools/download_manager.py | 14 +++++++++----- 1 file changed, 9 insertions(+), 5 deletions(-) diff --git a/relecov_tools/download_manager.py b/relecov_tools/download_manager.py index 3fab55f6..bf879121 100755 --- a/relecov_tools/download_manager.py +++ b/relecov_tools/download_manager.py @@ -571,12 +571,10 @@ def delete_remote_files(self, remote_folder, files=None, skip_seqs=False): files_to_remove = self.relecov_sftp.get_file_list(remote_folder) else: files_to_remove = files - if any(file.endswith(tuple(self.allowed_file_ext)) for file in files_to_remove): - if skip_seqs is True: - log_text = f"Folder {remote_folder} has sequencing files. Not removed." - log.warning(log_text) - return for file in files_to_remove: + if skip_seqs is True: + if file.endswith(tuple(self.allowed_file_ext)): + continue try: self.relecov_sftp.remove_file( os.path.join(remote_folder, os.path.basename(file)) @@ -590,6 +588,9 @@ def delete_remote_files(self, remote_folder, files=None, skip_seqs=False): def rename_remote_folder(self, remote_folder): if "tmp_processing" in remote_folder: new_name = remote_folder.replace("tmp_processing", "invalid_samples") + if new_name == remote_folder: + log.warning("Remote folder %s was already renamed", remote_folder) + return try: self.relecov_sftp.rename_file(remote_folder, new_name) if self.finished_folders.get(remote_folder): @@ -1266,6 +1267,9 @@ def execute_process(self): # If download_option is "download_clean", remove # sftp folder content after download is finished if self.download_option == "download_clean": + for folder in processed_folders: + self.delete_remote_files(folder, skip_seqs=True) + self.clean_remote_folder(folder) folders_to_clean = copy.deepcopy(self.finished_folders) for folder, downloaded_files in folders_to_clean.items(): self.delete_remote_files(folder, files=downloaded_files) From c0ce8d931d29afca578947b336402dc6677f720c Mon Sep 17 00:00:00 2001 From: Shettland Date: Mon, 7 Oct 2024 16:41:40 +0200 Subject: [PATCH 41/83] Now skips invalid_samples remote folders --- relecov_tools/download_manager.py | 3 +++ 1 file changed, 3 insertions(+) diff --git a/relecov_tools/download_manager.py b/relecov_tools/download_manager.py index bf879121..8f903bdd 100755 --- a/relecov_tools/download_manager.py +++ b/relecov_tools/download_manager.py @@ -863,6 +863,9 @@ def pre_validate_folder(folder, folder_files): log.info("Setting %s remote folders...", str(len(target_folders.keys()))) stderr.print(f"[blue]Setting {len(target_folders.keys())} remote folders...") for folder in sorted(target_folders.keys()): + if "invalid_samples" in folder: + log.warning("Skipped invalid_samples folder %s", folder) + continue self.current_folder = folder # Include the folder in the final process log summary self.include_new_key() From cb4bc9df4674f45aa85fc229d033f6523cbcd5f6 Mon Sep 17 00:00:00 2001 From: Shettland Date: Mon, 7 Oct 2024 16:42:41 +0200 Subject: [PATCH 42/83] Hotfix for wrong dict processing --- relecov_tools/download_manager.py | 14 +++++++++----- 1 file changed, 9 insertions(+), 5 deletions(-) diff --git a/relecov_tools/download_manager.py b/relecov_tools/download_manager.py index 8f903bdd..3c612791 100755 --- a/relecov_tools/download_manager.py +++ b/relecov_tools/download_manager.py @@ -1160,14 +1160,14 @@ def download(self, target_folders): stderr.print(f"[red]{error_text}") self.include_warning(error_text) - clean_fetchlist = [ + seqs_fetchlist = [ fi for fi in fetched_files if fi.endswith(tuple(self.allowed_file_ext)) ] - clean_fetchlist = [fi for fi in clean_fetchlist if fi not in corrupted] + seqs_fetchlist = [fi for fi in seqs_fetchlist if fi not in corrupted] # Checking for uncompressed files files_to_compress = [ fi - for fi in clean_fetchlist + for fi in seqs_fetchlist if not fi.endswith(".gz") and not fi.endswith(".bam") ] if files_to_compress: @@ -1175,8 +1175,10 @@ def download(self, target_folders): log.info("Found %s uncompressed files, compressing...", comp_files) stderr.print(f"Found {comp_files} uncompressed files, compressing...") clean_fetchlist = self.compress_and_update( - clean_fetchlist, files_to_compress, local_folder + seqs_fetchlist, files_to_compress, local_folder ) + else: + clean_fetchlist = seqs_fetchlist clean_pathlist = [os.path.join(local_folder, fi) for fi in clean_fetchlist] not_md5sum = [] if remote_md5sum: @@ -1205,7 +1207,9 @@ def download(self, target_folders): full_f_path = os.path.join(local_folder, file) if not relecov_tools.utils.check_gzip_integrity(full_f_path): corrupted.append(file) - files_md5_dict.pop(file, None) + files_md5_dict = { + x: y for x, y in files_md5_dict.items() if x not in corrupted + } processed_filedict = self.process_filedict( valid_filedict, clean_fetchlist, corrupted=corrupted, md5miss=not_md5sum ) From 1b353be1c655758847a1befdca5de454626c0876 Mon Sep 17 00:00:00 2001 From: Shettland Date: Mon, 7 Oct 2024 16:43:23 +0200 Subject: [PATCH 43/83] Removed first sleep time for reconnection decorator --- relecov_tools/sftp_client.py | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/relecov_tools/sftp_client.py b/relecov_tools/sftp_client.py index 0effba50..46a30c30 100644 --- a/relecov_tools/sftp_client.py +++ b/relecov_tools/sftp_client.py @@ -62,7 +62,7 @@ def __init__(self, conf_file=None, username=None, password=None): def reconnect_if_fail(n_times, sleep_time): def decorator(func): def retrier(self, *args, **kwargs): - more_sleep_time = sleep_time + more_sleep_time = 0 retries = 0 while retries < n_times: try: From 4925f3ccbbdab63eaebf77fe8465e540a24b67c8 Mon Sep 17 00:00:00 2001 From: Shettland Date: Mon, 7 Oct 2024 16:46:05 +0200 Subject: [PATCH 44/83] Introduced handling for missing/dup files --- relecov_tools/pipeline_manager.py | 58 ++++++++++++++++++------------- 1 file changed, 33 insertions(+), 25 deletions(-) diff --git a/relecov_tools/pipeline_manager.py b/relecov_tools/pipeline_manager.py index b7653289..ad9b687b 100644 --- a/relecov_tools/pipeline_manager.py +++ b/relecov_tools/pipeline_manager.py @@ -5,11 +5,12 @@ import re import shutil import sys +import copy from collections import Counter import rich.console - import relecov_tools.utils +from relecov_tools.log_summary import LogSum log = logging.getLogger(__name__) stderr = rich.console.Console( @@ -209,18 +210,8 @@ def get_latest_lab_folder(self): item["r2_fastq_filepath"], item["sequence_file_R2_fastq"] ) samples_data.append(sample) - date_and_time = datetime.datetime.today().strftime("%Y%m%d%-H%M%S") - with open( - os.path.join( - self.output_folder, - self.doc_folder, - f"{date_and_time}_validate_batch.json", - ), - "w", - ) as fo: - json.dump(join_validate, fo, indent=4, ensure_ascii=False) - - return samples_data + + return samples_data, join_validate def pipeline_exc(self): """Prepare folder for analysis in HPC @@ -239,7 +230,7 @@ def pipeline_exc(self): # create the 00_reads folder os.makedirs(self.linked_sample_folder, exist_ok=True) # collect json with all validated samples - samples_data = self.join_valid_items() + samples_data, join_validate = self.join_valid_items() # Check for possible duplicates # Extract the sequencing_sample_id from the list of dictionaries @@ -258,13 +249,9 @@ def pipeline_exc(self): ) sys.exit() - # print samples_id file - with open(os.path.join(self.analysis_folder, "samples_id.txt"), "w") as f: - for sample_id in sample_ids: - f.write(f"{sample_id}\n") - # iterate over the sample_data to copy the fastq files in the output folder file_errors = [] + samp_errors = [] copied_samples = 0 if len(samples_data) == 0: stderr.print("[yellow] No samples were found. Deleting analysis folder") @@ -293,6 +280,9 @@ def pipeline_exc(self): except FileNotFoundError as e: log.error("File not found %s", e) file_errors.append(sample["r1_fastq_filepath"]) + if "r2_fastq_filepath" in sample: + file_errors.append(sample["r2_fastq_filepath"]) + samp_errors.append(sample["sequencing_sample_id"]) continue copied_samples += 1 # check if there is a r2 file @@ -316,21 +306,39 @@ def pipeline_exc(self): except FileNotFoundError as e: log.error("File not found %s", e) file_errors.append(sample["r2_fastq_filepath"]) + samp_errors.append(sample["sequencing_sample_id"]) continue - if len(file_errors) > 0: + if len(samp_errors) > 0: stderr.print( - "[red] Files do not found. Unable to copy", - "[red] " + str(len(file_errors)), - "[red]sample files", + "[red]Some files were not found. Unable to copy files from", + "[red]" + str(len(samp_errors)) + " samples", ) msg = "Do you want to delete analysis folder? Y/N" confirmation = relecov_tools.utils.prompt_yn_question(msg) if confirmation: shutil.rmtree(self.output_folder) sys.exit(1) + + final_valid_samples = [ + x for x in join_validate if x.get("sequencing_sample_id") not in samp_errors + ] + sample_ids = [i for i in sample_ids if i not in samp_errors] + # print samples_id file + stderr.print(f"[blue]Generating sample_id.txt file in {self.analysis_folder}") + with open(os.path.join(self.analysis_folder, "samples_id.txt"), "w") as f: + for sample_id in sample_ids: + f.write(f"{sample_id}\n") + + date_and_time = datetime.datetime.today().strftime("%Y%m%d%-H%M%S") + json_filename = os.path.join( + self.output_folder, + self.doc_folder, + f"{date_and_time}_validate_batch.json", + ) + relecov_tools.utils.write_json_fo_file(final_valid_samples, json_filename) stderr.print("[green] Samples copied: ", copied_samples) - log.info("[blue] Pipeline launched successfully") - stderr.print("[blue] Pipeline launched successfully") + log.info("[blue]Successfully created pipeline folder. Ready to launch ") + stderr.print("[blue]Successfully created pipeline folder. Ready to launch") return From ff6017cdc733830d683d291c2fde9cab071fd2d2 Mon Sep 17 00:00:00 2001 From: Shettland Date: Mon, 7 Oct 2024 16:47:32 +0200 Subject: [PATCH 45/83] Introduced handling for missing/dup files. Linting --- relecov_tools/pipeline_manager.py | 2 -- 1 file changed, 2 deletions(-) diff --git a/relecov_tools/pipeline_manager.py b/relecov_tools/pipeline_manager.py index ad9b687b..318b037d 100644 --- a/relecov_tools/pipeline_manager.py +++ b/relecov_tools/pipeline_manager.py @@ -5,12 +5,10 @@ import re import shutil import sys -import copy from collections import Counter import rich.console import relecov_tools.utils -from relecov_tools.log_summary import LogSum log = logging.getLogger(__name__) stderr = rich.console.Console( From 3dd5fd7d7170cc46d558c87ef3d7bce0eb236be9 Mon Sep 17 00:00:00 2001 From: Shettland Date: Mon, 7 Oct 2024 16:57:13 +0200 Subject: [PATCH 46/83] Updated CHANGELOG.md --- CHANGELOG.md | 11 +++++++++-- 1 file changed, 9 insertions(+), 2 deletions(-) diff --git a/CHANGELOG.md b/CHANGELOG.md index 113748e3..d71fb328 100755 --- a/CHANGELOG.md +++ b/CHANGELOG.md @@ -4,7 +4,7 @@ All notable changes to this project will be documented in this file. The format is based on [Keep a Changelog](https://keepachangelog.com/en/1.0.0/), and this project adheres to [Semantic Versioning](https://semver.org/spec/v2.0.0.html). -## [1.2.0] - 2024-09-XX : https://github.com/BU-ISCIII/relecov-tools/releases/tag/1.2.0 +## [1.2.0] - 2024-09-0X : https://github.com/BU-ISCIII/relecov-tools/releases/tag/1.2.0 ### Credits @@ -16,6 +16,8 @@ Code contributions to the release: ### Modules +- Included wrapper module to launch download, read-lab-metadata and validate processes sequentially + #### Added enhancements - Now also check for gzip file integrity after download. Moved cleaning process to end of workflow [#313](https://github.com/BU-ISCIII/relecov-tools/pull/313) @@ -24,10 +26,14 @@ Code contributions to the release: - samples_data json file is no longer mandatory as input in read-lab-metadata [#314](https://github.com/BU-ISCIII/relecov-tools/pull/314) - Included handling of alternative column names to support two distinct headers using the same schema in read-lab-metadata [#314](https://github.com/BU-ISCIII/relecov-tools/pull/314) - Included a new hospital (Hospital Universitario Araba) to laboratory_address.json [#315](https://github.com/BU-ISCIII/relecov-tools/pull/315) +- More accurate cleaning process, skipping only sequencing files instead of whole folder [#321](https://github.com/BU-ISCIII/relecov-tools/pull/321) +- Now single logs summaries are also created for each folder during download [#321](https://github.com/BU-ISCIII/relecov-tools/pull/321) +- Introduced handling for missing/dup files and more accurate information in prompt for pipeline_manager [#321](https://github.com/BU-ISCIII/relecov-tools/pull/321) #### Fixes - Fixed wrong city name in relecov_tools/conf/laboratory_address.json [#320](https://github.com/BU-ISCIII/relecov-tools/pull/320) +- Fixed wrong single-paired layout detection in metadata due to Capital letters [#321](https://github.com/BU-ISCIII/relecov-tools/pull/321) #### Changed @@ -37,12 +43,13 @@ Code contributions to the release: - Now python lint only triggers when PR includes python files [#320](https://github.com/BU-ISCIII/relecov-tools/pull/320) - Moved concurrency to whole workflow instead of each step in test_sftp-handle.yml [#320](https://github.com/BU-ISCIII/relecov-tools/pull/320) - Updated test_sftp-handle.yml testing datasets [#320](https://github.com/BU-ISCIII/relecov-tools/pull/320) - +- Now download skips folders containing "invalid_samples" in its name [#321](https://github.com/BU-ISCIII/relecov-tools/pull/321) #### Removed - Removed duplicated tests with pushes after PR was merged in test_sftp-handle [#312](https://github.com/BU-ISCIII/relecov-tools/pull/312) - Deleted deprecated auto-release in pypi_publish as it does not work with tag pushes anymore [#312](https://github.com/BU-ISCIII/relecov-tools/pull/312) +- Removed first sleep time for reconnection decorator in sftp_client.py, sleep time now increases in the second attempt [#321](https://github.com/BU-ISCIII/relecov-tools/pull/321) ### Requirements From 0b75ff2120c1d9ead3ad8575c7ed17a4332aff23 Mon Sep 17 00:00:00 2001 From: Shettland Date: Tue, 8 Oct 2024 12:02:25 +0200 Subject: [PATCH 47/83] New method to adjust excel sheet size --- relecov_tools/utils.py | 26 ++++++++++++++++++++++++++ 1 file changed, 26 insertions(+) diff --git a/relecov_tools/utils.py b/relecov_tools/utils.py index 90af3d5f..cefd80a4 100755 --- a/relecov_tools/utils.py +++ b/relecov_tools/utils.py @@ -19,6 +19,9 @@ from rich.console import Console from datetime import datetime from tabulate import tabulate +import openpyxl.utils +import openpyxl.styles + log = logging.getLogger(__name__) @@ -488,3 +491,26 @@ def prompt_create_outdir( sys.exit(1) return global_path + +def adjust_sheet_size(sheet, wrap_text=True, col_width=30): + """Adjust column width and row heights depending on the max number of + characters in each one. + + Args: + sheet (openpyxl.worksheet): active openpyxl worksheet object + wrap_text (bool): Wether to use excel wrap_text function for each cell. Defaults to True + col_width (int): Minimum columns width value. Also used to define maximum + number of characters in each cell when wrap_text is True. Defaults to 30. + """ + dims = {} + for _, row in enumerate(sheet.iter_rows(min_row=2, max_row=sheet.max_row), start=2): + for cell in row: + if wrap_text: + cell.alignment = openpyxl.styles.Alignment(wrapText=True) + if cell.value is not None: + max_length = max((dims.get(cell.column, 0), len(str(cell.value)))) + dims[cell.column] = max_length / col_width + for col_num, value in dims.items(): + if value < col_width: + value = col_width + sheet.column_dimensions[openpyxl.utils.get_column_letter(col_num)].width = value From 5bea30b3ad6c840d330e6bd9c6546fea0d2ae135 Mon Sep 17 00:00:00 2001 From: Shettland Date: Tue, 8 Oct 2024 12:02:51 +0200 Subject: [PATCH 48/83] New method to adjust excel sheet size. Linting --- relecov_tools/utils.py | 1 + 1 file changed, 1 insertion(+) diff --git a/relecov_tools/utils.py b/relecov_tools/utils.py index cefd80a4..c3a1d5ad 100755 --- a/relecov_tools/utils.py +++ b/relecov_tools/utils.py @@ -492,6 +492,7 @@ def prompt_create_outdir( return global_path + def adjust_sheet_size(sheet, wrap_text=True, col_width=30): """Adjust column width and row heights depending on the max number of characters in each one. From 117689b81b065e54dfd4d2d4644b9a3ac7b29e56 Mon Sep 17 00:00:00 2001 From: Shettland Date: Tue, 8 Oct 2024 12:09:02 +0200 Subject: [PATCH 49/83] Included excel resize and handled exceptions in create_summary --- relecov_tools/log_summary.py | 36 +++++++++++++++++++++++++----------- 1 file changed, 25 insertions(+), 11 deletions(-) diff --git a/relecov_tools/log_summary.py b/relecov_tools/log_summary.py index 926b7900..4ca2001e 100755 --- a/relecov_tools/log_summary.py +++ b/relecov_tools/log_summary.py @@ -10,6 +10,7 @@ from datetime import datetime from collections import OrderedDict from relecov_tools.utils import rich_force_colors +import relecov_tools.utils log = logging.getLogger(__name__) @@ -191,13 +192,14 @@ def translate_fields(samples_logs): main_worksheet.append(error_row) warning_row = [sample, str(logs["valid"]), "; ".join(logs["warnings"])] warnings_sheet.append(warning_row) - excel_outpath = os.path.join(self.output_location, excel_filename) + relecov_tools.utils.adjust_sheet_size(main_worksheet) + relecov_tools.utils.adjust_sheet_size(warnings_sheet) workbook.save(excel_outpath) stderr.print(f"[green]Successfully created logs excel in {excel_outpath}") return def create_error_summary( - self, called_module=None, filename=None, logs=None, to_excel=False + self, called_module=None, filepath=None, logs=None, to_excel=False ): """Dump the log summary dictionary into a file with json format. If any of the 'errors' key is not empty, the parent key value 'valid' is set to false. @@ -223,15 +225,27 @@ def create_error_summary( ][0] except IndexError: called_module = "" - if not filename: + if not filepath: date = datetime.today().strftime("%Y%m%d%-H%M%S") filename = "_".join([date, called_module, "log_summary.json"]) - summary_path = os.path.join(self.output_location, filename) - with open(summary_path, "w", encoding="utf-8") as f: - f.write( - json.dumps(final_logs, indent=4, sort_keys=False, ensure_ascii=False) - ) - stderr.print(f"Process log summary saved in {summary_path}") - if to_excel is True: - self.create_logs_excel(final_logs, called_module) + os.makedirs(self.output_location, exist_ok=True) + filepath = os.path.join(self.output_location, filename) + else: + os.makedirs(os.path.dirname(filepath), exist_ok=True) + with open(filepath, "w", encoding="utf-8") as f: + try: + f.write( + json.dumps( + final_logs, indent=4, sort_keys=False, ensure_ascii=False + ) + ) + stderr.print(f"Process log summary saved in {filepath}") + if to_excel is True: + self.create_logs_excel( + final_logs, filepath.replace("log_summary", "report") + ) + except Exception as e: + stderr.print(f"[red]Error parsing logs to json format: {e}") + log.error("Error parsing logs to json format: %s", str(e)) + f.write(str(final_logs)) return From 1bf4f21d33fa29dd0e1c3893bddafed5ee092d7c Mon Sep 17 00:00:00 2001 From: Shettland Date: Tue, 8 Oct 2024 12:10:02 +0200 Subject: [PATCH 50/83] Handling non-existing output_location --- relecov_tools/log_summary.py | 10 ++++++---- 1 file changed, 6 insertions(+), 4 deletions(-) diff --git a/relecov_tools/log_summary.py b/relecov_tools/log_summary.py index 4ca2001e..dbb7af19 100755 --- a/relecov_tools/log_summary.py +++ b/relecov_tools/log_summary.py @@ -29,10 +29,12 @@ def __init__( unique_key: str = None, path: str = None, ): - if not os.path.exists(str(output_location)): - raise FileNotFoundError(f"Output folder {output_location} does not exist") - else: - self.output_location = output_location + if not os.path.isdir(str(output_location)): + try: + os.makedirs(output_location, exist_ok=True) + except IOError: + raise IOError(f"Logs output folder {output_location} does not exist") + self.output_location = output_location # if unique_key is given, all entries will be saved inside that key by default if unique_key: self.unique_key = unique_key From 8aff8675f1b0bbb0de12e44c784cd25083a194e9 Mon Sep 17 00:00:00 2001 From: Shettland Date: Tue, 8 Oct 2024 12:12:07 +0200 Subject: [PATCH 51/83] Error handling in merge_logs() and create_logs_excel() methods --- relecov_tools/log_summary.py | 68 +++++++++++++++++++++++++----------- 1 file changed, 47 insertions(+), 21 deletions(-) diff --git a/relecov_tools/log_summary.py b/relecov_tools/log_summary.py index dbb7af19..2e5c8474 100755 --- a/relecov_tools/log_summary.py +++ b/relecov_tools/log_summary.py @@ -120,7 +120,7 @@ def prepare_final_logs(self, logs): logs: logs with updated valid field values """ for key in logs.keys(): - if logs[key]["errors"]: + if logs[key].get("errors"): logs[key]["valid"] = False if logs[key].get("samples") is not None: for sample in logs[key]["samples"].keys(): @@ -129,16 +129,23 @@ def prepare_final_logs(self, logs): return logs def merge_logs(self, key_name, logs_list): - """Merge a multiple set of logs without losing information""" - if not logs_list: - return - merged_logs = copy.deepcopy(logs_list[0]) - if not merged_logs["samples"]: - merged_logs["samples"] = {} - for logs in logs_list: - merged_logs["errors"].extend(logs["errors"]) - merged_logs["warnings"].extend(logs["warnings"]) - if "samples" in logs.keys(): + """Merge a multiple set of logs without losing information + + Args: + key_name (str): Name of the final key holding the logs + logs_list (list(dict)): List of logs for different processes, + logs should only include the actual records, + + Returns: + final_logs (dict): Merged list of logs into a single record + """ + + def add_new_logs(merged_logs, logs): + if "errors" not in logs.keys(): + logs = logs.get(list(logs.keys())[0]) + merged_logs["errors"].extend(logs.get("errors")) + merged_logs["warnings"].extend(logs.get("warnings")) + if logs.get("samples"): for sample, vals in logs["samples"].items(): if sample not in merged_logs["samples"].keys(): merged_logs["samples"][sample] = vals @@ -149,34 +156,53 @@ def merge_logs(self, key_name, logs_list): merged_logs["samples"][sample]["warnings"].extend( logs["samples"][sample]["warnings"] ) + return merged_logs + + if not logs_list: + return + merged_logs = OrderedDict({"valid": True, "errors": [], "warnings": []}) + merged_logs["samples"] = {} + for idx, logs in enumerate(logs_list): + if not logs: + continue + try: + merged_logs = add_new_logs(merged_logs, logs) + except (TypeError, KeyError) as e: + err = f"Could not add logs {idx} in list: {e}" + merged_logs["errors"].extend(err) + log.error(err) final_logs = {key_name: merged_logs} return final_logs - def create_logs_excel(self, logs, called_module=""): + def create_logs_excel(self, logs, excel_outpath): """Create an excel file with logs information Args: logs (dict, optional): Custom dictionary of logs. Useful to create outputs - called_module (str, optional): Name of the module running this code. + excel_outpath (str): Path to output excel file """ def translate_fields(samples_logs): # TODO Translate logs to spanish using a local translator model like deepl return - date = datetime.today().strftime("%Y%m%d%-H%M%S") + date = datetime.today().strftime("%Y%m%d%H%M%S") lab_code = list(logs.keys())[0] - if self.unique_key: - excel_filename = "_".join( - [self.unique_key, called_module, date, "report.xlsx"] - ).replace("__", "") - else: - excel_filename = "_".join([lab_code, date, "report.xlsx"]) + if not os.path.exists(os.path.dirname(excel_outpath)): + excel_outpath = os.path.join( + self.output_location, lab_code + "_" + date + "_report.xlsx" + ) + log.warning( + "Given report outpath does not exist, changed to %s" % (excel_outpath) + ) + file_ext = os.path.splitext(excel_outpath)[-1] + excel_outpath = excel_outpath.replace(file_ext, ".xlsx") if not logs.get("samples"): try: - samples_logs = logs[lab_code].get("samples") + samples_logs = logs[lab_code]["samples"] except (KeyError, AttributeError) as e: stderr.print(f"[red]Could not convert log summary to excel: {e}") + log.error("Could not convert log summary to excel: %s" % str(e)) return else: samples_logs = logs.get("samples") From df2be34c85e0cf3a12f51fc2505a3ac552be3ef1 Mon Sep 17 00:00:00 2001 From: Shettland Date: Tue, 8 Oct 2024 12:13:55 +0200 Subject: [PATCH 52/83] Updated logs-to-excel output filename --- relecov_tools/__main__.py | 4 +++- 1 file changed, 3 insertions(+), 1 deletion(-) diff --git a/relecov_tools/__main__.py b/relecov_tools/__main__.py index 978d17b9..cc1aeeed 100755 --- a/relecov_tools/__main__.py +++ b/relecov_tools/__main__.py @@ -24,6 +24,7 @@ import relecov_tools.upload_ena_protocol import relecov_tools.pipeline_manager import relecov_tools.build_schema +import relecov_tools.dataprocess_wrapper log = logging.getLogger() @@ -565,7 +566,8 @@ def logs_to_excel(lab_code, output_folder, files): logsum = relecov_tools.log_summary.LogSum(output_location=output_folder) merged_logs = logsum.merge_logs(key_name=lab_code, logs_list=all_logs) final_logs = logsum.prepare_final_logs(logs=merged_logs) - logsum.create_logs_excel(logs=final_logs) + excel_outpath = os.path.join(output_folder, lab_code + "_logs_report.xlsx") + logsum.create_logs_excel(logs=final_logs, excel_outpath=excel_outpath) @relecov_tools_cli.command(help_priority=16) From 1639dd2f56567466386f5d8bc1625d13e955d1ee Mon Sep 17 00:00:00 2001 From: Shettland Date: Tue, 8 Oct 2024 13:53:33 +0200 Subject: [PATCH 53/83] Brackets annotations are removed from logs excel --- relecov_tools/log_summary.py | 13 +++++++++++-- 1 file changed, 11 insertions(+), 2 deletions(-) diff --git a/relecov_tools/log_summary.py b/relecov_tools/log_summary.py index 2e5c8474..bb74995c 100755 --- a/relecov_tools/log_summary.py +++ b/relecov_tools/log_summary.py @@ -4,6 +4,7 @@ import os import inspect import copy +import re import openpyxl from rich.console import Console @@ -181,6 +182,11 @@ def create_logs_excel(self, logs, excel_outpath): logs (dict, optional): Custom dictionary of logs. Useful to create outputs excel_outpath (str): Path to output excel file """ + def reg_remover(string, pattern): + """Remove annotation between brackets in logs message""" + string = string.replace("['", "'").replace("']", "'") + string = re.sub(pattern, '', string) + return string.strip() def translate_fields(samples_logs): # TODO Translate logs to spanish using a local translator model like deepl @@ -215,10 +221,13 @@ def translate_fields(samples_logs): warnings_sheet = workbook.create_sheet("Other warnings") warnings_headers = ["Sample ID given for sequencing", "Valid", "Warnings"] warnings_sheet.append(warnings_headers) + regex = r"\[.*?\]" # Regex to remove annotation between brackets for sample, logs in samples_logs.items(): - error_row = [sample, str(logs["valid"]), "; ".join(logs["errors"])] + clean_errors = [reg_remover(x, regex) for x in logs["errors"]] + error_row = [sample, str(logs["valid"]), "\n ".join(clean_errors)] main_worksheet.append(error_row) - warning_row = [sample, str(logs["valid"]), "; ".join(logs["warnings"])] + clean_warngs = [reg_remover(x, regex) for x in logs["warnings"]] + warning_row = [sample, str(logs["valid"]), "\n ".join(clean_warngs)] warnings_sheet.append(warning_row) relecov_tools.utils.adjust_sheet_size(main_worksheet) relecov_tools.utils.adjust_sheet_size(warnings_sheet) From 4ea982dbf9c0c6870d982691eb5bfc1482756be7 Mon Sep 17 00:00:00 2001 From: Shettland Date: Tue, 8 Oct 2024 14:00:01 +0200 Subject: [PATCH 54/83] Now error messages are reported based on the label --- relecov_tools/json_validation.py | 21 ++++++++++++++------- 1 file changed, 14 insertions(+), 7 deletions(-) diff --git a/relecov_tools/json_validation.py b/relecov_tools/json_validation.py index cb0cd05a..98364983 100755 --- a/relecov_tools/json_validation.py +++ b/relecov_tools/json_validation.py @@ -94,6 +94,7 @@ def validate_instances(self): # create validator validator = Draft202012Validator(self.json_schema) + schema_props = self.json_schema["properties"] validated_json_data = [] invalid_json = [] @@ -112,18 +113,24 @@ def validate_instances(self): else: # Count error types for error in validator.iter_errors(item_row): + if error.validator == "required": + error_field = [ + f for f in error.validator_value if f in error.message + ][0] + else: + error_field = error.absolute_path[0] try: - error_keys[error.message] = error.absolute_path[0] - except Exception: - error_keys[error.message] = error.message + err_field_label = schema_props[error_field]["label"] + except KeyError: + log.error("Could not extract label for %s" % error_field) + err_field_label = error_field + error.message.replace(error_field, err_field_label) + error_text = f"Error in column {err_field_label}: {error.message}" + error_keys[error.message] = error_field if error.message in errors: errors[error.message] += 1 else: errors[error.message] = 1 - if error_keys[error.message] == error.message: - error_text = error.message - else: - error_text = f"{error_keys[error.message]}:{error.message}" self.logsum.add_error(sample=sample_id_value, entry=error_text) # append row with errors invalid_json.append(item_row) From e830d10f329df1fe4ebcfd78362406d86869f0e2 Mon Sep 17 00:00:00 2001 From: Shettland Date: Tue, 8 Oct 2024 14:00:49 +0200 Subject: [PATCH 55/83] Check if input json file is a list of dicts first --- relecov_tools/json_validation.py | 4 ++++ 1 file changed, 4 insertions(+) diff --git a/relecov_tools/json_validation.py b/relecov_tools/json_validation.py index 98364983..6fcd2b13 100755 --- a/relecov_tools/json_validation.py +++ b/relecov_tools/json_validation.py @@ -60,6 +60,10 @@ def __init__( stderr.print("[blue] Reading the json file") self.json_data = relecov_tools.utils.read_json_file(json_data_file) + if isinstance(self.json_data, dict): + stderr.print(f"[red]Invalid json file content in {json_data_file}.") + stderr.print("Should be a list of dicts. Create it with read-lab-metadata") + sys.exit(1) self.metadata = metadata try: self.sample_id_field = self.get_sample_id_field() From f4b32cd32087826fa76cfad2b682fa89a909a11e Mon Sep 17 00:00:00 2001 From: Shettland Date: Tue, 8 Oct 2024 14:02:07 +0200 Subject: [PATCH 56/83] Included handling of multiple empty rows in metadata xlsx file --- relecov_tools/json_validation.py | 19 ++++++++++++++----- 1 file changed, 14 insertions(+), 5 deletions(-) diff --git a/relecov_tools/json_validation.py b/relecov_tools/json_validation.py index 6fcd2b13..5b8c553b 100755 --- a/relecov_tools/json_validation.py +++ b/relecov_tools/json_validation.py @@ -186,13 +186,22 @@ def create_invalid_metadata(self, invalid_json, metadata, out_folder): wb = openpyxl.load_workbook(metadata) # TODO: Include this as a key in configuration.json ws_sheet = wb["METADATA_LAB"] + tag = "Sample ID given for sequencing" + seq_id_col = [idx for idx, cell in enumerate(ws_sheet[1]) if tag in cell.value] + if seq_id_col: + id_col = seq_id_col[0] row_to_del = [] - for row in ws_sheet.iter_rows(min_row=5, max_row=ws_sheet.max_row): - # if not data on row 1 and 2 assume that no more data are in file - # then start deleting rows - if not row[2].value and not row[1].value: + row_iterator = ws_sheet.iter_rows(min_row=1, max_row=ws_sheet.max_row) + consec_empty_rows = 0 + for row in row_iterator: + # if no data in 10 consecutive rows, break loop + if not any(row[x].value for x in range(10)): + row_to_del.append(row[0].row) + consec_empty_rows += 1 + if consec_empty_rows > 10: break - if str(row[2].value) not in sample_list: + consec_empty_rows = 0 + if str(row[id_col].value) not in sample_list: row_to_del.append(row[0].row) stderr.print("Collected rows to create the excel file") if len(row_to_del) > 0: From c703299988e3b75f86d5e74998a2240edcee5834 Mon Sep 17 00:00:00 2001 From: Shettland Date: Tue, 8 Oct 2024 14:03:16 +0200 Subject: [PATCH 57/83] Now validate returns data that will be used by wrapper --- relecov_tools/json_validation.py | 1 + 1 file changed, 1 insertion(+) diff --git a/relecov_tools/json_validation.py b/relecov_tools/json_validation.py index 5b8c553b..d49d5ed7 100755 --- a/relecov_tools/json_validation.py +++ b/relecov_tools/json_validation.py @@ -258,3 +258,4 @@ def validate(self): self.logsum.add_error(entry=log_text) stderr.print(f"[red]{log_text}") self.logsum.create_error_summary(called_module="validate") + return valid_json_data, invalid_json From 9f78410f2ff75f05b1c2f4fce00275354c7b333b Mon Sep 17 00:00:00 2001 From: Shettland Date: Tue, 8 Oct 2024 14:05:33 +0200 Subject: [PATCH 58/83] Some warnings now include label. Also removed trailing spaces from cell values --- relecov_tools/read_lab_metadata.py | 19 +++++++++++-------- 1 file changed, 11 insertions(+), 8 deletions(-) diff --git a/relecov_tools/read_lab_metadata.py b/relecov_tools/read_lab_metadata.py index 3431c189..1aa27352 100755 --- a/relecov_tools/read_lab_metadata.py +++ b/relecov_tools/read_lab_metadata.py @@ -176,8 +176,8 @@ def match_to_json(self, valid_metadata_rows): if sample_id in samples_json.keys(): clean_metadata_rows.append(row) else: - log_text = "Sample missing in samples data Json file" - self.logsum.add_error(sample=sample_id, entry=log_text) + log_text = "Sample in metadata but missing in downloaded samples file" + self.logsum.add_warning(sample=sample_id, entry=log_text) missing_samples.append(sample_id) return clean_metadata_rows, missing_samples @@ -264,6 +264,7 @@ def adding_ontology_to_enum(self, m_data): def process_from_json(self, m_data, json_fields): """Find the labels that are missing in the file to match the given schema.""" map_field = json_fields["map_field"] + col_name = self.relecov_sch_json["properties"].get(map_field).get("label") json_data = json_fields["j_data"] for idx in range(len(m_data)): sample_id = str(m_data[idx].get("sequencing_sample_id")) @@ -274,14 +275,14 @@ def process_from_json(self, m_data, json_fields): clean_error = re.sub("[\[].*?[\]]", "", str(error.args[0])) if str(clean_error).lower().strip() == "not provided": log_text = ( - f"Label {map_field} was not provided in sample " + f"Label {col_name} was not provided in sample " + f"{sample_id}, auto-completing with Not Provided" ) self.logsum.add_warning(sample=sample_id, entry=log_text) else: log_text = ( - f"Unknown map_field value {error} for json data: " - + f"{str(map_field)} in sample {sample_id}. Skipped" + f"Unknown field value {error} for json data: " + + f"{str(col_name)} in sample {sample_id}. Skipped" ) self.logsum.add_warning(sample=sample_id, entry=log_text) continue @@ -383,7 +384,7 @@ def read_metadata_file(self): if isinstance(row[key], dtime): row[key] = str(row[key].date()) elif re.match(pattern, str(row[key])): - row[key] = row[key].replace("/", "-").replace(".", "-") + row[key] = str(row[key]).replace("/", "-").replace(".", "-") row[key] = re.match(pattern, row[key]).group(0) else: try: @@ -408,11 +409,13 @@ def read_metadata_file(self): alt_key = alt_header_dict.get(key) if row[key] is not None or "not provided" not in str(row[key]).lower(): try: - property_row[self.label_prop_dict[key]] = row[key] + property_row[self.label_prop_dict[key]] = str(row[key]).strip() except KeyError as e: if self.alternative_heading: try: - property_row[self.label_prop_dict[alt_key]] = row[key] + property_row[self.label_prop_dict[alt_key]] = str( + row[key] + ).strip() continue except KeyError: pass From 43d3d0fb0b01931f828ba317ec4a60880346c5f0 Mon Sep 17 00:00:00 2001 From: Shettland Date: Tue, 8 Oct 2024 14:08:32 +0200 Subject: [PATCH 59/83] New wrapper module --- relecov_tools/dataprocess_wrapper.py | 267 +++++++++++++++++++++++++++ 1 file changed, 267 insertions(+) create mode 100644 relecov_tools/dataprocess_wrapper.py diff --git a/relecov_tools/dataprocess_wrapper.py b/relecov_tools/dataprocess_wrapper.py new file mode 100644 index 00000000..13ca6abe --- /dev/null +++ b/relecov_tools/dataprocess_wrapper.py @@ -0,0 +1,267 @@ +#!/usr/bin/env python +import logging +import re +import yaml +import os +import sys +from datetime import datetime +import json +import inspect +import rich.console +from relecov_tools.download_manager import DownloadManager +from relecov_tools.read_lab_metadata import RelecovMetadata +from relecov_tools.json_validation import SchemaValidation +import relecov_tools.log_summary +import relecov_tools.utils + +log = logging.getLogger(__name__) +stderr = rich.console.Console( + stderr=True, + style="dim", + highlight=False, + force_terminal=relecov_tools.utils.rich_force_colors(), +) + + +class ProcessWrapper: + """ + Always fill all the arguments for the class in the config file, leave its value + if you dont want to use that argument e.g.(target_folders: ) -> (target_folders = None) + """ + + def __init__(self, config_file: str = None, output_folder: str = None): + if not os.path.isdir(str(output_folder)): + sys.exit(FileNotFoundError(f"Output folder {output_folder} is not valid")) + else: + self.output_folder = output_folder + if not os.path.isfile(str(config_file)): + sys.exit(FileNotFoundError(f"Config file {config_file} is not a file")) + else: + try: + self.config_data = relecov_tools.utils.read_yml_file(config_file) + # Config file should include a key + except yaml.YAMLError as e: + sys.exit(yaml.YAMLError(f"Invalid config file: {e}")) + output_regex = ("out_folder", "output_folder", "output_location") + for key, val in self.config_data.items(): + for arg in output_regex: + if val == arg: + self.config_data[key] = self.output_folder + self.wrapper_logsum = relecov_tools.log_summary.LogSum( + output_location=os.path.join(self.output_folder, "logs") + ) + self.config_data["download"].update({"output_location": output_folder}) + self.download_params = self.clean_module_params( + "DownloadManager", self.config_data["download"] + ) + self.readmeta_params = self.clean_module_params( + "RelecovMetadata", self.config_data["read-lab-metadata"] + ) + self.validate_params = self.clean_module_params( + "SchemaValidation", self.config_data["validate"] + ) + + def clean_module_params(self, module, params): + active_module = eval(module) + module_args = inspect.getfullargspec(active_module.__init__)[0] + module_args.remove("self") + module_valid_params = {x: y for x, y in params.items() if x in module_args} + if not module_valid_params: + stderr.print(f"[red]Invalid params for {module} in config file") + sys.exit(1) + return module_valid_params + + def exec_download(self, download_params): + download_manager = DownloadManager(**download_params) + download_manager.execute_process() + finished_folders = download_manager.finished_folders + download_logs = self.wrapper_logsum.prepare_final_logs( + logs=download_manager.logsum.logs + ) + self.download_manager = download_manager + return finished_folders, download_logs + + def exec_read_metadata(self, readmeta_params): + read_metadata = RelecovMetadata(**readmeta_params) + read_metadata.create_metadata_json() + read_meta_logs = self.wrapper_logsum.prepare_final_logs( + logs=read_metadata.logsum.logs + ) + return read_meta_logs + + def exec_validation(self, validate_params): + validate_proccess = SchemaValidation(**validate_params) + valid_json_data, invalid_json = validate_proccess.validate() + validate_logs = self.wrapper_logsum.prepare_final_logs( + logs=validate_proccess.logsum.logs + ) + return valid_json_data, invalid_json, validate_logs + + def process_folder(self, finished_folders, key, folder_logs): + """_summary_ + + Args: + finished_folders (_type_): _description_ + key (_type_): _description_ + folder_logs (_type_): _description_ + + Raises: + ValueError: _description_ + KeyError: _description_ + ValueError: _description_ + ValueError: _description_ + + Returns: + _type_: _description_ + """ + + def upload_files_from_json(invalid_json, remote_dir): + """Upload the files in a given json with samples metadata""" + for sample in invalid_json: + local_dir = sample.get("r1_fastq_filepath") + # files_keys = [key for key in sample.keys() if "_file_" in key] + sample_files = ( + sample.get("sequence_file_R1_fastq"), + sample.get("sequence_file_R2_fastq"), + ) + ftp_files = self.download_manager.relecov_sftp.get_file_list(remote_dir) + uploaded_files = [] + for file in sample_files: + if not file or file in ftp_files: + continue + loc_path = os.path.join(local_dir, file) + sftp_path = os.path.join(remote_dir, file) + log.info("Uploading %s to remote %s" % (loc_path, remote_dir)) + uploaded = self.download_manager.relecov_sftp.upload_file( + loc_path, sftp_path + ) + if not uploaded: + err = f"Could not upload {loc_path} to {remote_dir}" + self.wrapper_logsum.add_error(sample=sample, entry=err) + else: + uploaded_files.append(file) + return uploaded_files + + local_folder = folder_logs.get("path") + match_date = re.search(r"\/\d{4}\d{2}\d{2}\d{6}", local_folder) + sftp_dirs = self.download_manager.relecov_sftp.list_remote_folders(key) + sftp_dirs_paths = [os.path.join(key, d) for d in sftp_dirs] + valid_dirs = [d for d in sftp_dirs_paths if d in finished_folders.keys()] + if not valid_dirs or len(valid_dirs) >= 2: + logtxt = f"Could not find {key} folder in remote sftp. Skipped" + raise KeyError(logtxt) + # As all folders are merged into one during download, there should only be 1 folder + remote_dir = valid_dirs[0] + if not local_folder: + raise ValueError() + files = [os.path.join(local_folder, file) for file in os.listdir(local_folder)] + try: + metadata_file = [x for x in files if re.search("lab_metadata.*.xlsx", x)][0] + samples_file = [x for x in files if re.search("samples_data.*.json", x)][0] + except IndexError: + raise ValueError(f"No metadata/samples files found after download") + self.readmeta_params.update( + { + "metadata_file": metadata_file, + "sample_list_file": samples_file, + "output_folder": local_folder, + } + ) + read_meta_logs = self.exec_read_metadata(self.readmeta_params) + metadata_json = [ + x for x in os.listdir(local_folder) if re.search("lab_metadata.*.json", x) + ] + if not metadata_json: + raise ValueError(f"No metadata json found after read-lab-metadata") + self.validate_params.update( + { + "json_data_file": os.path.join(local_folder, metadata_json[0]), + "metadata": metadata_file, + "out_folder": local_folder, + } + ) + valid_json_data, invalid_json, validate_logs = self.exec_validation( + self.validate_params + ) + merged_logs = self.wrapper_logsum.merge_logs( + key_name=key, logs_list=[{key: folder_logs}, read_meta_logs, validate_logs] + ) + stderr.print(f"[green]Merged logs from all processes in {local_folder}") + if invalid_json: + logtxt = f"Found {len(invalid_json)} invalid samples in {key}" + self.wrapper_logsum.add_warning(key=key, entry=logtxt) + assets = os.path.join(os.path.dirname(os.path.realpath(__file__)), "assets") + metadata_template = [ + x for x in os.listdir(assets) if re.search("metadata_templat.*.xlsx", x) + ][0] + sftp_path = os.path.join(remote_dir, os.path.basename(metadata_template)) + stderr.print(f"[blue]Uploading invalid files and template to {remote_dir}") + self.download_manager.relecov_sftp.upload_file( + os.path.join(assets, metadata_template), sftp_path + ) + upload_files_from_json(invalid_json, remote_dir) + stderr.print(f"[blue]Cleaning successfully validated files from {remote_dir}") + log.info("Cleaning successfully validated files from remote dir") + file_fields = ("sequence_file_R1_fastq", "sequence_file_R2_fastq") + valid_sampfiles = [f.get(key) for key in file_fields for f in valid_json_data] + valid_files = [f for f in finished_folders[remote_dir] if f in valid_sampfiles] + self.download_manager.delete_remote_files(key, files=valid_files) + self.download_manager.delete_remote_files(key, skip_seqs=True) + self.download_manager.clean_remote_folder(key) + log_filepath = os.path.join(local_folder, str(key) + "_metadata_report.json") + self.wrapper_logsum.create_error_summary( + called_module="metadata", + filepath=log_filepath, + logs=merged_logs, + to_excel=True, + ) + xlsx_report_files = [ + f for f in os.listdir(local_folder) if re.search("metadata_report.xlsx", f) + ] + if xlsx_report_files: + log.info("Uploading %s xlsx report to remote %s" % (key, remote_dir)) + local_xlsx = os.path.join(local_folder, xlsx_report_files[0]) + remote_xlsx = os.path.join(remote_dir, xlsx_report_files[0]) + up = self.download_manager.relecov_sftp.upload_file(local_xlsx, remote_xlsx) + if not up: + log.error( + "Could not upload %s report to remote %s" % (key, local_folder) + ) + else: + log.error("Could not find xlsx report for %s in %s" % (key, logs_dir)) + return merged_logs, valid_json_data + + def run_wrapper(self): + """Execute each given process in config file sequentially""" + finished_folders, download_logs = self.exec_download(self.download_params) + if not finished_folders: + stderr.print("[red]No valid folders found to process") + sys.exit(1) + date = datetime.today().strftime("%Y%m%d%H%M%S") + for key, folder_logs in download_logs.items(): + folder = folder_logs.get("path") + if not folder: + continue + if not folder_logs.get("valid"): + continue + try: + merged_logs, valid_json_data = self.process_folder( + finished_folders, key, folder_logs + ) + except FileNotFoundError as e: + log.error(f"Could not process folder {key}: {e}") + folder_logs["errors"].append(f"Could not process folder {key}: {e}") + log_filepath = os.path.join(folder, str(key) + "_metadata_summary.json") + self.wrapper_logsum.create_error_summary( + called_module="metadata", + filepath=log_filepath, + logs={key: folder_logs}, + to_excel=False, + ) + continue + self.wrapper_logsum.logs[key] = merged_logs[key] + self.wrapper_logsum.create_error_summary( + called_module="wrapper", + to_excel=True, + ) + return From f96faa4eea64fb97fc397077237abb78d8b33769 Mon Sep 17 00:00:00 2001 From: Shettland Date: Tue, 8 Oct 2024 14:10:58 +0200 Subject: [PATCH 60/83] Brackets removal. Linting --- relecov_tools/log_summary.py | 5 +++-- 1 file changed, 3 insertions(+), 2 deletions(-) diff --git a/relecov_tools/log_summary.py b/relecov_tools/log_summary.py index bb74995c..0e92b47f 100755 --- a/relecov_tools/log_summary.py +++ b/relecov_tools/log_summary.py @@ -182,10 +182,11 @@ def create_logs_excel(self, logs, excel_outpath): logs (dict, optional): Custom dictionary of logs. Useful to create outputs excel_outpath (str): Path to output excel file """ + def reg_remover(string, pattern): """Remove annotation between brackets in logs message""" string = string.replace("['", "'").replace("']", "'") - string = re.sub(pattern, '', string) + string = re.sub(pattern, "", string) return string.strip() def translate_fields(samples_logs): @@ -221,7 +222,7 @@ def translate_fields(samples_logs): warnings_sheet = workbook.create_sheet("Other warnings") warnings_headers = ["Sample ID given for sequencing", "Valid", "Warnings"] warnings_sheet.append(warnings_headers) - regex = r"\[.*?\]" # Regex to remove annotation between brackets + regex = r"\[.*?\]" # Regex to remove annotation between brackets for sample, logs in samples_logs.items(): clean_errors = [reg_remover(x, regex) for x in logs["errors"]] error_row = [sample, str(logs["valid"]), "\n ".join(clean_errors)] From c90bb7604db010731df164559a5fc453d84236cd Mon Sep 17 00:00:00 2001 From: Shettland Date: Tue, 8 Oct 2024 15:24:01 +0200 Subject: [PATCH 61/83] New wrapper module. linting --- relecov_tools/dataprocess_wrapper.py | 12 ++++++------ 1 file changed, 6 insertions(+), 6 deletions(-) diff --git a/relecov_tools/dataprocess_wrapper.py b/relecov_tools/dataprocess_wrapper.py index 13ca6abe..21225eb1 100644 --- a/relecov_tools/dataprocess_wrapper.py +++ b/relecov_tools/dataprocess_wrapper.py @@ -5,7 +5,6 @@ import os import sys from datetime import datetime -import json import inspect import rich.console from relecov_tools.download_manager import DownloadManager @@ -143,7 +142,6 @@ def upload_files_from_json(invalid_json, remote_dir): return uploaded_files local_folder = folder_logs.get("path") - match_date = re.search(r"\/\d{4}\d{2}\d{2}\d{6}", local_folder) sftp_dirs = self.download_manager.relecov_sftp.list_remote_folders(key) sftp_dirs_paths = [os.path.join(key, d) for d in sftp_dirs] valid_dirs = [d for d in sftp_dirs_paths if d in finished_folders.keys()] @@ -159,7 +157,7 @@ def upload_files_from_json(invalid_json, remote_dir): metadata_file = [x for x in files if re.search("lab_metadata.*.xlsx", x)][0] samples_file = [x for x in files if re.search("samples_data.*.json", x)][0] except IndexError: - raise ValueError(f"No metadata/samples files found after download") + raise ValueError("No metadata/samples files found after download") self.readmeta_params.update( { "metadata_file": metadata_file, @@ -172,7 +170,7 @@ def upload_files_from_json(invalid_json, remote_dir): x for x in os.listdir(local_folder) if re.search("lab_metadata.*.json", x) ] if not metadata_json: - raise ValueError(f"No metadata json found after read-lab-metadata") + raise ValueError("No metadata json found after read-lab-metadata") self.validate_params.update( { "json_data_file": os.path.join(local_folder, metadata_json[0]), @@ -228,7 +226,7 @@ def upload_files_from_json(invalid_json, remote_dir): "Could not upload %s report to remote %s" % (key, local_folder) ) else: - log.error("Could not find xlsx report for %s in %s" % (key, logs_dir)) + log.error("Could not find xlsx report for %s in %s" % (key, local_folder)) return merged_logs, valid_json_data def run_wrapper(self): @@ -251,7 +249,9 @@ def run_wrapper(self): except FileNotFoundError as e: log.error(f"Could not process folder {key}: {e}") folder_logs["errors"].append(f"Could not process folder {key}: {e}") - log_filepath = os.path.join(folder, str(key) + "_metadata_summary.json") + log_filepath = os.path.join( + folder, date + "_" + str(key) + "_wrapper_summary.json" + ) self.wrapper_logsum.create_error_summary( called_module="metadata", filepath=log_filepath, From 2857fe61aea24292bac999dfb9427aba8c1e245f Mon Sep 17 00:00:00 2001 From: Shettland Date: Tue, 8 Oct 2024 16:37:57 +0200 Subject: [PATCH 62/83] Included docstring for process_folder() --- relecov_tools/dataprocess_wrapper.py | 42 +++++++++++++++++----------- 1 file changed, 25 insertions(+), 17 deletions(-) diff --git a/relecov_tools/dataprocess_wrapper.py b/relecov_tools/dataprocess_wrapper.py index 21225eb1..b5755168 100644 --- a/relecov_tools/dataprocess_wrapper.py +++ b/relecov_tools/dataprocess_wrapper.py @@ -97,21 +97,27 @@ def exec_validation(self, validate_params): return valid_json_data, invalid_json, validate_logs def process_folder(self, finished_folders, key, folder_logs): - """_summary_ + """Executes read-lab-metadata and validation process for the given downloaded folder. + Merges all the log summaries generated with the ones from download process, creates + an excel file with custom format and uploads it back to its remote sftp folder. + Also uploads the files that failed validation back to the remote sftp folder. + Finally. It cleans all the remote remaining files if the process was successful. Args: - finished_folders (_type_): _description_ - key (_type_): _description_ - folder_logs (_type_): _description_ + finished_folders (dict(str:list)): Dictionary which includes the names + of the remote folders processed during download and the successfull files for each + key (str): Name of the folder to process in remote sftp, same name as the one + included in the log_summary from download process. + folder_logs (dict): Download log_summary corresponding to the processed folder Raises: - ValueError: _description_ - KeyError: _description_ - ValueError: _description_ - ValueError: _description_ + ValueError: If folder_logs dont include a path to the local folder + ValueError: If folder is not found in remote sftp or more than 1 + ValueError: If no samples/files are found for the folder after download + ValueError: If no metadata json file is found after read-lab-metadata Returns: - _type_: _description_ + merged_logs (dict): Dictionary which includes the logs from all processes """ def upload_files_from_json(invalid_json, remote_dir): @@ -147,11 +153,11 @@ def upload_files_from_json(invalid_json, remote_dir): valid_dirs = [d for d in sftp_dirs_paths if d in finished_folders.keys()] if not valid_dirs or len(valid_dirs) >= 2: logtxt = f"Could not find {key} folder in remote sftp. Skipped" - raise KeyError(logtxt) + raise ValueError(logtxt) # As all folders are merged into one during download, there should only be 1 folder remote_dir = valid_dirs[0] if not local_folder: - raise ValueError() + raise ValueError(f"Couldnt find local path for {key} in log after download") files = [os.path.join(local_folder, file) for file in os.listdir(local_folder)] try: metadata_file = [x for x in files if re.search("lab_metadata.*.xlsx", x)][0] @@ -227,10 +233,14 @@ def upload_files_from_json(invalid_json, remote_dir): ) else: log.error("Could not find xlsx report for %s in %s" % (key, local_folder)) - return merged_logs, valid_json_data + return merged_logs def run_wrapper(self): - """Execute each given process in config file sequentially""" + """Execute each given process in config file sequentially, starting with download. + Once the download has finished, each downloaded folder is processed using read-lab-metadata + and validation modules. The logs from each module are merged into a single log-summary. + These merged logs are then used to create an excel report of all the processes + """ finished_folders, download_logs = self.exec_download(self.download_params) if not finished_folders: stderr.print("[red]No valid folders found to process") @@ -243,10 +253,8 @@ def run_wrapper(self): if not folder_logs.get("valid"): continue try: - merged_logs, valid_json_data = self.process_folder( - finished_folders, key, folder_logs - ) - except FileNotFoundError as e: + merged_logs = self.process_folder(finished_folders, key, folder_logs) + except (FileNotFoundError, ValueError) as e: log.error(f"Could not process folder {key}: {e}") folder_logs["errors"].append(f"Could not process folder {key}: {e}") log_filepath = os.path.join( From 02617d9aaa81304306ef66dc911c10eaa361d8a3 Mon Sep 17 00:00:00 2001 From: Shettland Date: Tue, 8 Oct 2024 17:13:14 +0200 Subject: [PATCH 63/83] Handling removed remote folder prior to upload --- relecov_tools/dataprocess_wrapper.py | 31 +++++++++++++++------------- 1 file changed, 17 insertions(+), 14 deletions(-) diff --git a/relecov_tools/dataprocess_wrapper.py b/relecov_tools/dataprocess_wrapper.py index b5755168..ff786c9e 100644 --- a/relecov_tools/dataprocess_wrapper.py +++ b/relecov_tools/dataprocess_wrapper.py @@ -59,6 +59,7 @@ def __init__(self, config_file: str = None, output_folder: str = None): self.validate_params = self.clean_module_params( "SchemaValidation", self.config_data["validate"] ) + self.date = datetime.today().strftime("%Y%m%d%H%M%S") def clean_module_params(self, module, params): active_module = eval(module) @@ -148,14 +149,6 @@ def upload_files_from_json(invalid_json, remote_dir): return uploaded_files local_folder = folder_logs.get("path") - sftp_dirs = self.download_manager.relecov_sftp.list_remote_folders(key) - sftp_dirs_paths = [os.path.join(key, d) for d in sftp_dirs] - valid_dirs = [d for d in sftp_dirs_paths if d in finished_folders.keys()] - if not valid_dirs or len(valid_dirs) >= 2: - logtxt = f"Could not find {key} folder in remote sftp. Skipped" - raise ValueError(logtxt) - # As all folders are merged into one during download, there should only be 1 folder - remote_dir = valid_dirs[0] if not local_folder: raise ValueError(f"Couldnt find local path for {key} in log after download") files = [os.path.join(local_folder, file) for file in os.listdir(local_folder)] @@ -190,8 +183,18 @@ def upload_files_from_json(invalid_json, remote_dir): merged_logs = self.wrapper_logsum.merge_logs( key_name=key, logs_list=[{key: folder_logs}, read_meta_logs, validate_logs] ) - stderr.print(f"[green]Merged logs from all processes in {local_folder}") + sftp_dirs = self.download_manager.relecov_sftp.list_remote_folders(key) + sftp_dirs_paths = [os.path.join(key, d) for d in sftp_dirs] + valid_dirs = [d for d in sftp_dirs_paths if d in finished_folders.keys()] + if not valid_dirs or len(valid_dirs) >= 2: + # As all folders are merged into one during download, there should only be 1 folder + log.warning("Couldnt find %s folder in remote sftp. Creating new one", key) + remote_dir = os.path.join(key, self.date + "_invalid_samples") + self.download_manager.relecov_sftp.make_dir(remote_dir) + else: + remote_dir = valid_dirs[0] if invalid_json: + stderr.print(f"[green]Merged logs from all processes in {local_folder}") logtxt = f"Found {len(invalid_json)} invalid samples in {key}" self.wrapper_logsum.add_warning(key=key, entry=logtxt) assets = os.path.join(os.path.dirname(os.path.realpath(__file__)), "assets") @@ -203,15 +206,16 @@ def upload_files_from_json(invalid_json, remote_dir): self.download_manager.relecov_sftp.upload_file( os.path.join(assets, metadata_template), sftp_path ) + # Upload all the files that failed validation process back to sftp upload_files_from_json(invalid_json, remote_dir) stderr.print(f"[blue]Cleaning successfully validated files from {remote_dir}") log.info("Cleaning successfully validated files from remote dir") file_fields = ("sequence_file_R1_fastq", "sequence_file_R2_fastq") valid_sampfiles = [f.get(key) for key in file_fields for f in valid_json_data] valid_files = [f for f in finished_folders[remote_dir] if f in valid_sampfiles] - self.download_manager.delete_remote_files(key, files=valid_files) - self.download_manager.delete_remote_files(key, skip_seqs=True) - self.download_manager.clean_remote_folder(key) + self.download_manager.delete_remote_files(remote_dir, files=valid_files) + self.download_manager.delete_remote_files(remote_dir, skip_seqs=True) + self.download_manager.clean_remote_folder(remote_dir) log_filepath = os.path.join(local_folder, str(key) + "_metadata_report.json") self.wrapper_logsum.create_error_summary( called_module="metadata", @@ -245,7 +249,6 @@ def run_wrapper(self): if not finished_folders: stderr.print("[red]No valid folders found to process") sys.exit(1) - date = datetime.today().strftime("%Y%m%d%H%M%S") for key, folder_logs in download_logs.items(): folder = folder_logs.get("path") if not folder: @@ -258,7 +261,7 @@ def run_wrapper(self): log.error(f"Could not process folder {key}: {e}") folder_logs["errors"].append(f"Could not process folder {key}: {e}") log_filepath = os.path.join( - folder, date + "_" + str(key) + "_wrapper_summary.json" + folder, self.date + "_" + str(key) + "_wrapper_summary.json" ) self.wrapper_logsum.create_error_summary( called_module="metadata", From abea22caf30b160e6ca2d87aebaa91ed10aa276a Mon Sep 17 00:00:00 2001 From: Shettland Date: Wed, 9 Oct 2024 10:16:26 +0200 Subject: [PATCH 64/83] Moved cleaning in case remote folder was removed by download_clean --- relecov_tools/dataprocess_wrapper.py | 25 +++++++++++++++---------- 1 file changed, 15 insertions(+), 10 deletions(-) diff --git a/relecov_tools/dataprocess_wrapper.py b/relecov_tools/dataprocess_wrapper.py index ff786c9e..e9a2eaf2 100644 --- a/relecov_tools/dataprocess_wrapper.py +++ b/relecov_tools/dataprocess_wrapper.py @@ -183,18 +183,27 @@ def upload_files_from_json(invalid_json, remote_dir): merged_logs = self.wrapper_logsum.merge_logs( key_name=key, logs_list=[{key: folder_logs}, read_meta_logs, validate_logs] ) + stderr.print(f"[green]Merged logs from all processes in {local_folder}") sftp_dirs = self.download_manager.relecov_sftp.list_remote_folders(key) sftp_dirs_paths = [os.path.join(key, d) for d in sftp_dirs] valid_dirs = [d for d in sftp_dirs_paths if d in finished_folders.keys()] + # As all folders are merged into one during download, there should only be 1 folder if not valid_dirs or len(valid_dirs) >= 2: - # As all folders are merged into one during download, there should only be 1 folder + # If all samples were valid during download and download_clean is used, the original folder might have been deleted log.warning("Couldnt find %s folder in remote sftp. Creating new one", key) remote_dir = os.path.join(key, self.date + "_invalid_samples") self.download_manager.relecov_sftp.make_dir(remote_dir) else: remote_dir = valid_dirs[0] + stderr.print(f"[blue]Cleaning successfully validated files from {remote_dir}") + log.info("Cleaning successfully validated files from remote dir") + file_fields = ("sequence_file_R1_fastq", "sequence_file_R2_fastq") + valid_sampfiles = [f.get(key) for key in file_fields for f in valid_json_data] + valid_files = [f for f in finished_folders[remote_dir] if f in valid_sampfiles] + self.download_manager.delete_remote_files(remote_dir, files=valid_files) + self.download_manager.delete_remote_files(remote_dir, skip_seqs=True) + self.download_manager.clean_remote_folder(remote_dir) if invalid_json: - stderr.print(f"[green]Merged logs from all processes in {local_folder}") logtxt = f"Found {len(invalid_json)} invalid samples in {key}" self.wrapper_logsum.add_warning(key=key, entry=logtxt) assets = os.path.join(os.path.dirname(os.path.realpath(__file__)), "assets") @@ -202,20 +211,16 @@ def upload_files_from_json(invalid_json, remote_dir): x for x in os.listdir(assets) if re.search("metadata_templat.*.xlsx", x) ][0] sftp_path = os.path.join(remote_dir, os.path.basename(metadata_template)) + log.info("Uploading invalid files and template to %s", remote_dir) stderr.print(f"[blue]Uploading invalid files and template to {remote_dir}") self.download_manager.relecov_sftp.upload_file( os.path.join(assets, metadata_template), sftp_path ) # Upload all the files that failed validation process back to sftp upload_files_from_json(invalid_json, remote_dir) - stderr.print(f"[blue]Cleaning successfully validated files from {remote_dir}") - log.info("Cleaning successfully validated files from remote dir") - file_fields = ("sequence_file_R1_fastq", "sequence_file_R2_fastq") - valid_sampfiles = [f.get(key) for key in file_fields for f in valid_json_data] - valid_files = [f for f in finished_folders[remote_dir] if f in valid_sampfiles] - self.download_manager.delete_remote_files(remote_dir, files=valid_files) - self.download_manager.delete_remote_files(remote_dir, skip_seqs=True) - self.download_manager.clean_remote_folder(remote_dir) + else: + log.info("No invalid samples in %s", key) + stderr.print(f"[green]No invalid samples were found for {key} !!!") log_filepath = os.path.join(local_folder, str(key) + "_metadata_report.json") self.wrapper_logsum.create_error_summary( called_module="metadata", From a80cfb987f31893bf1804d024571e986c8bc91bb Mon Sep 17 00:00:00 2001 From: Shettland Date: Wed, 9 Oct 2024 10:27:57 +0200 Subject: [PATCH 65/83] Moved cleaning in case remote folder was removed. Linting --- relecov_tools/dataprocess_wrapper.py | 12 +++++++++--- 1 file changed, 9 insertions(+), 3 deletions(-) diff --git a/relecov_tools/dataprocess_wrapper.py b/relecov_tools/dataprocess_wrapper.py index e9a2eaf2..42877ccd 100644 --- a/relecov_tools/dataprocess_wrapper.py +++ b/relecov_tools/dataprocess_wrapper.py @@ -195,11 +195,17 @@ def upload_files_from_json(invalid_json, remote_dir): self.download_manager.relecov_sftp.make_dir(remote_dir) else: remote_dir = valid_dirs[0] - stderr.print(f"[blue]Cleaning successfully validated files from {remote_dir}") + stderr.print( + f"[blue]Cleaning successfully validated files from {remote_dir}" + ) log.info("Cleaning successfully validated files from remote dir") file_fields = ("sequence_file_R1_fastq", "sequence_file_R2_fastq") - valid_sampfiles = [f.get(key) for key in file_fields for f in valid_json_data] - valid_files = [f for f in finished_folders[remote_dir] if f in valid_sampfiles] + valid_sampfiles = [ + f.get(key) for key in file_fields for f in valid_json_data + ] + valid_files = [ + f for f in finished_folders[remote_dir] if f in valid_sampfiles + ] self.download_manager.delete_remote_files(remote_dir, files=valid_files) self.download_manager.delete_remote_files(remote_dir, skip_seqs=True) self.download_manager.clean_remote_folder(remote_dir) From 59b36fab3bab1e717352dfbf3a73f578b7d604d8 Mon Sep 17 00:00:00 2001 From: Shettland Date: Wed, 9 Oct 2024 14:34:54 +0200 Subject: [PATCH 66/83] Included processed batchs and samples in log_summary --- relecov_tools/read_bioinfo_metadata.py | 8 ++++++-- 1 file changed, 6 insertions(+), 2 deletions(-) diff --git a/relecov_tools/read_bioinfo_metadata.py b/relecov_tools/read_bioinfo_metadata.py index 27ee09aa..98aa0b9f 100755 --- a/relecov_tools/read_bioinfo_metadata.py +++ b/relecov_tools/read_bioinfo_metadata.py @@ -300,7 +300,6 @@ def handling_tables(self, file_list, conf_tab_name): file_ext = os.path.splitext(conf_tab_name)[1] # Parsing key position sample_idx_colpos = self.get_sample_idx_colpos(self.current_config_key) - # TODO: What if you need to process one table for each sample? extdict = {".csv": ",", ".tsv": "\t", ".tab": "\t"} if file_ext in extdict.keys(): data = relecov_tools.utils.read_csv_file_return_dict( @@ -738,6 +737,7 @@ def split_tables_by_batch(self, files_found_dict, batch_data, output_dir): def extract_batch_rows_to_file(file): """Create a new table file only with rows matching samples in batch_data""" + extdict = {".csv": ",", ".tsv": "\t", ".tab": "\t"} file_extension = os.path.splitext(file)[1] file_df = pd.read_csv( file, sep=extdict.get(file_extension), header=header_pos @@ -754,7 +754,6 @@ def extract_batch_rows_to_file(file): method_name = self.split_tables_by_batch.__name__ namekey = "sequencing_sample_id" batch_samples = [row.get(namekey) for row in batch_data] - extdict = {".csv": ",", ".tsv": "\t", ".tab": "\t"} for key, files in files_found_dict.items(): if not self.software_config[key].get("split_by_batch"): continue @@ -793,6 +792,7 @@ def create_bioinfo_file(self): data_by_batch = self.split_data_by_batch(self.j_data) # Add bioinfo metadata to j_data for batch_dir, batch_dict in data_by_batch.items(): + self.log_report.logsum.feed_key(batch_dir) stderr.print(f"[blue]Processing data from {batch_dir}") batch_data = batch_dict["j_data"] stderr.print("[blue]Adding bioinfo metadata to read lab metadata...") @@ -815,6 +815,10 @@ def create_bioinfo_file(self): batch_filename = tag + lab_code + "_" + batch_date + ".json" batch_filepath = os.path.join(batch_dir, batch_filename) relecov_tools.utils.write_json_fo_file(batch_data, batch_filepath) + for sample in batch_data: + self.log_report.logsum.feed_key( + key=batch_dir, sample=sample.get("sequencing_sample_id") + ) log.info("Created output json file: %s" % batch_filepath) stderr.print(f"[green]Created batch json file: {batch_filepath}") stderr.print("[blue]Writting output json file") From 42f98b246c43d5a1c2aea0880a97509fd43372f5 Mon Sep 17 00:00:00 2001 From: Shettland Date: Wed, 9 Oct 2024 14:37:01 +0200 Subject: [PATCH 67/83] Better log readability --- relecov_tools/upload_database.py | 12 ++++++------ 1 file changed, 6 insertions(+), 6 deletions(-) diff --git a/relecov_tools/upload_database.py b/relecov_tools/upload_database.py index eb5d5c4f..ffcb673f 100644 --- a/relecov_tools/upload_database.py +++ b/relecov_tools/upload_database.py @@ -259,24 +259,24 @@ def update_database(self, field_values, post_url): if "ERROR" not in result: break if i == 9 and "ERROR" in result: - logtxt = f"Unable to sent the request to {self.platform}" + logtxt = f"Unable to sent the request to {post_url}" self.logsum.add_error(entry=logtxt, sample=req_sample) stderr.print(f"[red]{logtxt}") continue elif "is not defined" in result["ERROR_TEST"].lower(): error_txt = result["ERROR_TEST"] - logtxt = f"Sample {req_sample}: {error_txt}" + logtxt = f"Sample {req_sample} failed in {post_url}: {error_txt}" self.logsum.add_error(entry=logtxt, sample=req_sample) stderr.print(f"[yellow]Warning: {logtxt}") continue elif "already defined" in result["ERROR_TEST"].lower(): - logtxt = f"Request to {self.platform} already defined" + logtxt = f"Request to {post_url} already defined" self.logsum.add_warning(entry=logtxt, sample=req_sample) stderr.print(f"[yellow]{logtxt} for sample {req_sample}") continue else: - logtxt = f"Error {result['ERROR']} in request to {self.platform}" + logtxt = f"Error {result['ERROR']} in request to {post_url}" self.logsum.add_error(entry=logtxt, sample=req_sample) stderr.print(f"[red]{logtxt}") continue @@ -298,7 +298,7 @@ def update_database(self, field_values, post_url): sample=req_sample, ) stderr.print( - f"[yellow]logtxt % {suces_count} {request_count} {self.platform})" + f"[yellow]{logtxt % (suces_count, request_count, self.platform)}" ) return @@ -363,7 +363,7 @@ def update_db(self): self.server_name = "relecov" self.start_api(self.server_name) - for datatype in self.types_of_data: + for datatype in ["sample", "bioinfodata", "variantdata"]: log_text = f"Sending {datatype} data to {self.server_name}" log.info(log_text) stderr.print(log_text) From 377b8ea5f63ac6ba0b487a1a0d5e9781dc34ce1f Mon Sep 17 00:00:00 2001 From: Shettland Date: Wed, 9 Oct 2024 14:38:10 +0200 Subject: [PATCH 68/83] Changed setup and main versions to 1.2.0 --- relecov_tools/__main__.py | 2 +- setup.py | 2 +- 2 files changed, 2 insertions(+), 2 deletions(-) diff --git a/relecov_tools/__main__.py b/relecov_tools/__main__.py index cc1aeeed..12ea61d0 100755 --- a/relecov_tools/__main__.py +++ b/relecov_tools/__main__.py @@ -62,7 +62,7 @@ def run_relecov_tools(): ) # stderr.print("[green] `._,._,'\n", highlight=False) - __version__ = "1.1.0" + __version__ = "1.2.0" stderr.print( "\n" "[grey39] RELECOV-tools version {}".format(__version__), highlight=False ) diff --git a/setup.py b/setup.py index b721a1c6..596177f2 100644 --- a/setup.py +++ b/setup.py @@ -2,7 +2,7 @@ from setuptools import setup, find_packages -version = "1.1.0" +version = "1.2.0" with open("README.md") as f: readme = f.read() From f9f3d4b52e63fe53f1fb483cf2bb51a88a00f7d9 Mon Sep 17 00:00:00 2001 From: Shettland Date: Wed, 9 Oct 2024 14:39:06 +0200 Subject: [PATCH 69/83] Fixed wrong parameter description in wrapper --- relecov_tools/__main__.py | 4 ++-- 1 file changed, 2 insertions(+), 2 deletions(-) diff --git a/relecov_tools/__main__.py b/relecov_tools/__main__.py index 12ea61d0..77cf1ef7 100755 --- a/relecov_tools/__main__.py +++ b/relecov_tools/__main__.py @@ -575,14 +575,14 @@ def logs_to_excel(lab_code, output_folder, files): "-c", "--config_file", type=click.Path(), - help="Path to config file in yaml format", + help="Path to config file in yaml format [required]", required=True, ) @click.option( "-o", "--output_folder", type=click.Path(), - help="Path to the base schema file. This file is used as a reference to compare it with the schema generated using this module. (Default: installed schema in 'relecov-tools/relecov_tools/schema/relecov_schema.json')", + help="Path to folder where global results are saved [required]", required=False, ) def wrapper(config_file, output_folder): From f3c564dad89419359ccf0688ab46acb8b7fe0f67 Mon Sep 17 00:00:00 2001 From: Shettland Date: Wed, 9 Oct 2024 14:44:26 +0200 Subject: [PATCH 70/83] Updated modules and wrapper description --- README.md | 45 +++++++++++++++++++++++++++++++-------------- 1 file changed, 31 insertions(+), 14 deletions(-) diff --git a/README.md b/README.md index 8d9b7453..a24351d9 100644 --- a/README.md +++ b/README.md @@ -24,7 +24,8 @@ relecov-tools is a set of helper tools for the assembly of the different element - [upload-to-ena](#upload-to-ena) - [upload-to-gisaid](#upload-to-gisaid) - [update-db](#update-db) - - [launch-pipeline](#launch-pipeline) + - [pipeline-manager](#pipeline-manager) + - [wrapper](#wrapper) - [logs-to-excel](#logs-to-excel) - [build-schema](#build-schema) - [Mandatory Fields](#mandatory-fields) @@ -63,7 +64,7 @@ $ relecov-tools --help \ \ / |__ / |__ | |___ | | | \ / / / \ | \ | | | | | | \ / / |--| | \ |___ |___ |___ |___ |___| \/ -RELECOV-tools version 1.1.0 +RELECOV-tools version 1.2.0 Usage: relecov-tools [OPTIONS] COMMAND [ARGS]... Options: @@ -73,16 +74,19 @@ Options: --help Show this message and exit. Commands: - download Download files located in sftp server. - read-lab-metadata Create the json compliant to the relecov schema from... - read-bioinfo-metadata Create the json compliant to the relecov schema with Bioinfo Metadata. - validate Validate json file against schema. - map Convert data between phage plus schema to ENA,... - upload-to-ena parsed data to create xml files to upload to ena - upload-to-gisaid parsed data to create files to upload to gisaid - update-db feed database with metadata jsons - build-schema Generates and updates JSON Schema files from... - launch-pipeline Create the symbolic links for the samples which... + download Download files located in sftp server. + read-lab-metadata Create the json compliant to the relecov schema... + validate Validate json file against schema. + map Convert data between phage plus schema to ENA,... + upload-to-ena parse data to create xml files to upload to ena + upload-to-gisaid parsed data to create files to upload to gisaid + update-db upload the information included in json file to... + read-bioinfo-metadata Create the json compliant from the Bioinfo... + metadata-homogeneizer Parse institution metadata lab to the one used... + pipeline-manager Create the symbolic links for the samples which... + wrapper Execute download, read-lab-metadata and validate... + build-schema Generates and updates JSON Schema files from... + logs-to-excel Creates a merged xlsx report from all the log... ``` #### download The command `download` connects to a transfer protocol (currently sftp) and downloads all files in the different available folders in the passed credentials. In addition, it checks if the files in the current folder match the files in the metadata file and also checks if there are md5sum for each file. Else, it creates one before storing in the final repository. @@ -247,10 +251,10 @@ Usage: relecov-tools upload-to-gisaid [OPTIONS] -t, --type Select the type of information to upload to database [sample,bioinfodata,variantdata] -d, --databaseServer Name of the database server receiving the data [iskylims,relecov] -#### launch-pipeline +#### pipeline-manager Create the folder structure to execute the given pipeline for the latest sample batches after executing download, read-lab-metadata and validate modules. This module will create symbolic links for each sample and generate the necessary files for pipeline execution using the information from validated_BATCH-NAME_DATE.json. ``` -Usage: relecov-tools launch-pipeline [OPTIONS] +Usage: relecov-tools pipeline-manager [OPTIONS] Create the symbolic links for the samples which are validated to prepare for bioinformatics pipeline execution. @@ -263,6 +267,19 @@ Options: --help Show this message and exit. ``` +#### wrapper +Execute download, read-lab-metadata and validate sequentially using a config file to fill the arguments for each one. It also creates a global report with all the logs for the three processes in a user-friendly .xlsx format. The config file should include the name of each module that is executed, along with the necessary parameters in YAML format. +``` +Usage: relecov-tools wrapper [OPTIONS] + + Executes the modules in config file sequentially + +Options: + -c, --config_file PATH Path to config file in yaml format [required] + -o, --output_folder PATH Path to folder where global results are saved [required] + --help Show this message and exit. +``` + #### logs-to-excel Creates an xlsx file with all the entries found for a specified laboratory in a given set of log_summary.json files (from log-summary module). The laboratory name must match the name of one of the keys in the provided logs to work. ``` From 190253f8c705905b303baa6603a4a2d085281d46 Mon Sep 17 00:00:00 2001 From: Shettland Date: Wed, 9 Oct 2024 15:09:59 +0200 Subject: [PATCH 71/83] Changed launch-pipeline for pipeline-manager for cli --- relecov_tools/__main__.py | 4 ++-- relecov_tools/pipeline_manager.py | 2 +- 2 files changed, 3 insertions(+), 3 deletions(-) diff --git a/relecov_tools/__main__.py b/relecov_tools/__main__.py index 77cf1ef7..0ef86437 100755 --- a/relecov_tools/__main__.py +++ b/relecov_tools/__main__.py @@ -477,12 +477,12 @@ def metadata_homogeneizer(institution, directory, output): help="select the template config file", ) @click.option("-o", "--output", type=click.Path(), help="select output folder") -def launch_pipeline(input, template, output, config): +def pipeline_manager(input, template, output, config): """ Create the symbolic links for the samples which are validated to prepare for bioinformatics pipeline execution. """ - new_launch = relecov_tools.pipeline_manager.LaunchPipeline( + new_launch = relecov_tools.pipeline_manager.PipelineManager( input, template, output, config ) new_launch.pipeline_exc() diff --git a/relecov_tools/pipeline_manager.py b/relecov_tools/pipeline_manager.py index 318b037d..8c18547e 100644 --- a/relecov_tools/pipeline_manager.py +++ b/relecov_tools/pipeline_manager.py @@ -19,7 +19,7 @@ ) -class LaunchPipeline: +class PipelineManager: def __init__( self, input_folder=None, From c4a87eaeac09046dffc214d633f6c4c7284f28de Mon Sep 17 00:00:00 2001 From: Shettland Date: Thu, 10 Oct 2024 17:20:12 +0200 Subject: [PATCH 72/83] Now samples_data.json is created if not given as input --- relecov_tools/read_lab_metadata.py | 14 ++++++++++++-- 1 file changed, 12 insertions(+), 2 deletions(-) diff --git a/relecov_tools/read_lab_metadata.py b/relecov_tools/read_lab_metadata.py index 1aa27352..8e7701f1 100755 --- a/relecov_tools/read_lab_metadata.py +++ b/relecov_tools/read_lab_metadata.py @@ -77,7 +77,7 @@ def __init__(self, metadata_file=None, sample_list_file=None, output_folder=None "[orange]Property " + prop + " does not have 'label' attribute" ) continue - + self.date = dtime.now().strftime("%Y%m%d%H%M%S") self.json_req_files = config_json.get_topic_data( "lab_metadata", "lab_metadata_req_json" ) @@ -119,6 +119,8 @@ def safely_calculate_md5(file): ) else: md5_dict = {} + log.warning("No md5sum file found.") + log.warning("Generating new md5 hashes. This might take a while...") j_data = {} no_fastq_error = "No R1 fastq was given for sample %s" for sample in clean_metadata_rows: @@ -134,6 +136,7 @@ def safely_calculate_md5(file): continue r1_md5 = md5_dict.get(r1_file) r2_md5 = md5_dict.get(r2_file) + files_dict["sequence_file_R1_fastq"] = r1_file files_dict["r1_fastq_filepath"] = dir_path if r1_md5: files_dict["fastq_r1_md5"] = r1_md5 @@ -142,6 +145,7 @@ def safely_calculate_md5(file): os.path.join(dir_path, r1_file) ) if r2_file: + files_dict["sequence_file_R2_fastq"] = r2_file files_dict["r2_fastq_filepath"] = dir_path if r2_md5: files_dict["fastq_r2_md5"] = r2_md5 @@ -150,6 +154,12 @@ def safely_calculate_md5(file): os.path.join(dir_path, r2_file) ) j_data[str(sample.get("sequencing_sample_id"))] = files_dict + try: + filename = "_".join(["samples_data", self.lab_code, self.date + ".json"]) + file_path = os.path.join(self.output_folder, filename) + relecov_tools.utils.write_json_fo_file(j_data, file_path) + except Exception: + log.error("Could not output samples_data.json file to output folder") return j_data def match_to_json(self, valid_metadata_rows): @@ -450,7 +460,7 @@ def create_metadata_json(self): stderr.print("Metadata was completely empty. No output file generated") sys.exit(1) file_code = "lab_metadata_" + self.lab_code + "_" - file_name = file_code + dtime.now().strftime("%Y%m%d%H%M%S") + ".json" + file_name = file_code + self.date + ".json" stderr.print("[blue]Writting output json file") os.makedirs(self.output_folder, exist_ok=True) self.logsum.create_error_summary(called_module="read-lab-metadata") From c7183fbc96892a2d151e8f7faae916d401de8da5 Mon Sep 17 00:00:00 2001 From: Shettland Date: Thu, 10 Oct 2024 18:10:08 +0200 Subject: [PATCH 73/83] Better logging in wrapper --- relecov_tools/dataprocess_wrapper.py | 4 ++++ 1 file changed, 4 insertions(+) diff --git a/relecov_tools/dataprocess_wrapper.py b/relecov_tools/dataprocess_wrapper.py index 42877ccd..5d34104c 100644 --- a/relecov_tools/dataprocess_wrapper.py +++ b/relecov_tools/dataprocess_wrapper.py @@ -261,11 +261,15 @@ def run_wrapper(self): stderr.print("[red]No valid folders found to process") sys.exit(1) for key, folder_logs in download_logs.items(): + log.info(f"Processing folder {key}") folder = folder_logs.get("path") if not folder: + log.error(f"Skipped folder {key}. Logs do not include path field") continue if not folder_logs.get("valid"): + log.error(f"Folder {key} is set as invalid in logs. Skipped.") continue + stderr.print(f"Processing folder {key} with local path: {folder}") try: merged_logs = self.process_folder(finished_folders, key, folder_logs) except (FileNotFoundError, ValueError) as e: From e3021f91795faceea9837e3f3f70945949526b58 Mon Sep 17 00:00:00 2001 From: Shettland Date: Fri, 11 Oct 2024 12:53:07 +0200 Subject: [PATCH 74/83] Handling rows without required sample_id --- relecov_tools/read_lab_metadata.py | 14 ++++++++------ 1 file changed, 8 insertions(+), 6 deletions(-) diff --git a/relecov_tools/read_lab_metadata.py b/relecov_tools/read_lab_metadata.py index 8e7701f1..3285d473 100755 --- a/relecov_tools/read_lab_metadata.py +++ b/relecov_tools/read_lab_metadata.py @@ -37,7 +37,7 @@ def __init__(self, metadata_file=None, sample_list_file=None, output_folder=None sys.exit(1) if sample_list_file is None: - stderr.print("[Yellow]No samples_data.json file provided") + stderr.print("[yellow]No samples_data.json file provided") self.sample_list_file = sample_list_file if sample_list_file is not None and not os.path.exists(sample_list_file): @@ -376,8 +376,11 @@ def read_metadata_file(self): try: sample_id = str(row[sample_id_col]).strip() except KeyError: - log_text = f"Sample ID given for sequencing empty in row {row_number}" - log.error(log_text) + self.logsum.add_error(entry=f"No {sample_id_col} found in excel file") + continue + if not row[sample_id_col] or "Not Provided" in sample_id: + log_text = f"{sample_id_col} not provided in row {row_number}. Skipped" + self.logsum.add_warning(entry=log_text) stderr.print(f"[red]{log_text}") continue for key in row.keys(): @@ -443,9 +446,8 @@ def create_metadata_json(self): clean_metadata_rows, missing_samples = self.match_to_json(valid_metadata_rows) if missing_samples: num_miss = len(missing_samples) - log.warning( - "%s samples from metadata were not found: %s", num_miss, missing_samples - ) + logtxt = "%s samples from metadata were not found: %s" % (num_miss, missing_samples) + self.logsum.add_warning(entry=logtxt) stderr.print(f"[yellow]{num_miss} samples missing:\n{missing_samples}") # Continue by adding extra information stderr.print("[blue]Including additional information") From 539dd2ccb15e90fc7ce3789b8eba7b5e1b30fd8e Mon Sep 17 00:00:00 2001 From: Shettland Date: Fri, 11 Oct 2024 12:54:55 +0200 Subject: [PATCH 75/83] Better logging for missing sample id --- relecov_tools/download_manager.py | 3 ++- 1 file changed, 2 insertions(+), 1 deletion(-) diff --git a/relecov_tools/download_manager.py b/relecov_tools/download_manager.py index 3c612791..17a13b1e 100755 --- a/relecov_tools/download_manager.py +++ b/relecov_tools/download_manager.py @@ -418,7 +418,8 @@ def get_sample_fastq_file_names(self, local_folder, meta_f_path): stderr.print(f"[red]{str(log_text % s_name)}") self.include_error(entry=str(log_text % s_name), sample=s_name) else: - self.include_warning(entry=f"Row {counter} skipped. No sample ID given") + txt = f"Row {counter} in metadata skipped.No sequencing sample ID given" + self.include_warning(entry=txt) # Remove duplicated files clean_sample_dict = self.remove_duplicated_values(sample_file_dict) return clean_sample_dict From 91846d15d7ad2ad4a3c5865cc7ce27e35c1768d2 Mon Sep 17 00:00:00 2001 From: Shettland Date: Fri, 11 Oct 2024 12:58:34 +0200 Subject: [PATCH 76/83] Better logging for wrapper --- relecov_tools/dataprocess_wrapper.py | 8 ++++++-- 1 file changed, 6 insertions(+), 2 deletions(-) diff --git a/relecov_tools/dataprocess_wrapper.py b/relecov_tools/dataprocess_wrapper.py index 5d34104c..4ba3e262 100644 --- a/relecov_tools/dataprocess_wrapper.py +++ b/relecov_tools/dataprocess_wrapper.py @@ -260,8 +260,9 @@ def run_wrapper(self): if not finished_folders: stderr.print("[red]No valid folders found to process") sys.exit(1) + stderr.print(f"[blue]Processing {len(finished_folders)} downloaded folders...") + counter = 0 for key, folder_logs in download_logs.items(): - log.info(f"Processing folder {key}") folder = folder_logs.get("path") if not folder: log.error(f"Skipped folder {key}. Logs do not include path field") @@ -269,7 +270,10 @@ def run_wrapper(self): if not folder_logs.get("valid"): log.error(f"Folder {key} is set as invalid in logs. Skipped.") continue - stderr.print(f"Processing folder {key} with local path: {folder}") + counter += 1 + logtxt = "Processing folder %s/%s: %s with local path %s" + log.info(logtxt % (counter, str(len(finished_folders)), key, folder)) + stderr.print(logtxt % (counter, str(len(finished_folders)), key, folder)) try: merged_logs = self.process_folder(finished_folders, key, folder_logs) except (FileNotFoundError, ValueError) as e: From 646183086e317998ed5c09deaffd2bc69c584063 Mon Sep 17 00:00:00 2001 From: Shettland Date: Fri, 11 Oct 2024 14:04:06 +0200 Subject: [PATCH 77/83] Better logging missing samples. Linting --- relecov_tools/read_lab_metadata.py | 4 ++-- 1 file changed, 2 insertions(+), 2 deletions(-) diff --git a/relecov_tools/read_lab_metadata.py b/relecov_tools/read_lab_metadata.py index 3285d473..13e072c8 100755 --- a/relecov_tools/read_lab_metadata.py +++ b/relecov_tools/read_lab_metadata.py @@ -446,8 +446,8 @@ def create_metadata_json(self): clean_metadata_rows, missing_samples = self.match_to_json(valid_metadata_rows) if missing_samples: num_miss = len(missing_samples) - logtxt = "%s samples from metadata were not found: %s" % (num_miss, missing_samples) - self.logsum.add_warning(entry=logtxt) + logtx = "%s samples not found in metadata: %s" % (num_miss, missing_samples) + self.logsum.add_warning(entry=logtx) stderr.print(f"[yellow]{num_miss} samples missing:\n{missing_samples}") # Continue by adding extra information stderr.print("[blue]Including additional information") From 94e619eee1af9680c0f38a1e3811c6d856af605c Mon Sep 17 00:00:00 2001 From: Shettland Date: Fri, 11 Oct 2024 14:04:50 +0200 Subject: [PATCH 78/83] Updated pipeline manager fields --- relecov_tools/conf/configuration.json | 5 +++-- 1 file changed, 3 insertions(+), 2 deletions(-) diff --git a/relecov_tools/conf/configuration.json b/relecov_tools/conf/configuration.json index af2081e4..d539d19f 100755 --- a/relecov_tools/conf/configuration.json +++ b/relecov_tools/conf/configuration.json @@ -432,8 +432,9 @@ ] } }, - "launch_pipeline": { - "analysis_name": "RELECOV_icasas_C", + "pipeline_manager": { + "analysis_group": "RLV", + "analysis_user": "icasas_C", "doc_folder": "DOC", "analysis_folder": "ANALYSIS", "sample_stored_folder": "RAW", From a8e107dbed0fc7577216f5bb68dac8d0d9bb8b4f Mon Sep 17 00:00:00 2001 From: Shettland Date: Fri, 11 Oct 2024 14:12:26 +0200 Subject: [PATCH 79/83] Now splits data into N folders based on enrichment_panel found in samples --- relecov_tools/pipeline_manager.py | 331 ++++++++++++++++++------------ 1 file changed, 195 insertions(+), 136 deletions(-) diff --git a/relecov_tools/pipeline_manager.py b/relecov_tools/pipeline_manager.py index 8c18547e..b78b8477 100644 --- a/relecov_tools/pipeline_manager.py +++ b/relecov_tools/pipeline_manager.py @@ -5,6 +5,7 @@ import re import shutil import sys +import re from collections import Counter import rich.console @@ -27,7 +28,7 @@ def __init__( output_folder=None, pipeline_conf_file=None, ): - current_date = datetime.date.today().strftime("%Y%m%d") + self.current_date = datetime.date.today().strftime("%Y%m%d") if input_folder is None: self.input_folder = relecov_tools.utils.prompt_path( msg="Select the folder which contains the fastq file of samples" @@ -62,23 +63,22 @@ def __init__( sys.exit(1) conf_settings = relecov_tools.utils.read_json_file(pipeline_conf_file) try: - data = conf_settings["launch_pipeline"] - # get_topic_data("launch_pipeline", "analysis_name") + config_data = conf_settings["pipeline_manager"] except KeyError: log.error("Invalid pipeline config file %s ", pipeline_conf_file) stderr.print("[red] Invalid pipeline config file " + pipeline_conf_file) if ( - "analysis_name" not in data - or "sample_stored_folder" not in data - or "sample_link_folder" not in data - or "doc_folder" not in data + "analysis_user" not in config_data + or "analysis_group" not in config_data + or "analysis_folder" not in config_data + or "sample_stored_folder" not in config_data + or "sample_link_folder" not in config_data + or "doc_folder" not in config_data ): - log.error("Invalid pipeline config file %s ", self.pipeline_conf_file) - stderr.print( - "[red] Invalid pipeline config file " + self.pipeline_conf_file - ) + log.error("Invalid pipeline config file %s ", pipeline_conf_file) + stderr.print("[red] Invalid pipeline config file " + pipeline_conf_file) sys.exit(1) - + self.config_fata = config_data if output_folder is None: output_folder = relecov_tools.utils.prompt_path( msg="Select the output folder" @@ -92,24 +92,12 @@ def __init__( sys.exit(1) # Update the output folder with the current date and analysis name - self.output_folder = os.path.join( - output_folder, current_date + "_" + data["analysis_name"] - ) - if os.path.exists(self.output_folder): - msg = "Analysis folder already exists and it will be deleted. Do you want to continue? Y/N" - confirmation = relecov_tools.utils.prompt_yn_question(msg) - if confirmation is False: - sys.exit(1) - shutil.rmtree(self.output_folder) - - self.analysis_folder = os.path.join(self.output_folder, data["analysis_folder"]) - self.copied_sample_folder = os.path.join( - self.output_folder, data["sample_stored_folder"] - ) - self.linked_sample_folder = os.path.join( - self.analysis_folder, data["sample_link_folder"] - ) - self.doc_folder = data["doc_folder"] + self.output_folder = output_folder + self.out_folder_namevar = f"{self.current_date}_{config_data['analysis_group']}_%s_{config_data['analysis_user']}" + self.analysis_folder = config_data["analysis_folder"] + self.copied_sample_folder = config_data["sample_stored_folder"] + self.linked_sample_folder = config_data["sample_link_folder"] + self.doc_folder = config_data["doc_folder"] def join_valid_items(self): """Join validated metadata for the latest batches downloaded @@ -175,14 +163,13 @@ def get_latest_lab_folder(self): return lab_latest_folders, latest_date upload_lab_folders, latest_date = get_latest_lab_folder(self) - samples_data = [] join_validate = list() for lab, data_folder in upload_lab_folders.items(): lab_code = lab.split("/")[-1] log.info("Collecting samples for %s", lab_code) stderr.print("[blue] Collecting samples for ", lab_code) # check if laboratory folder is the latest date to process - if data_folder["date"] != latest_date: + if data_folder["date"] != datetime.date(2024, 9, 30): # latest_date: continue # fetch the validate file and get sample id and r1 and r2 file path validate_files = [ @@ -197,146 +184,218 @@ def get_latest_lab_folder(self): with open(validate_file_path) as fh: data = json.load(fh) join_validate.extend(data) - for item in data: - sample = {} - sample["sequencing_sample_id"] = item["sequencing_sample_id"] - sample["r1_fastq_filepath"] = os.path.join( - item["r1_fastq_filepath"], item["sequence_file_R1_fastq"] - ) - if "r2_fastq_filepath" in item: - sample["r2_fastq_filepath"] = os.path.join( - item["r2_fastq_filepath"], item["sequence_file_R2_fastq"] - ) - samples_data.append(sample) - - return samples_data, join_validate - - def pipeline_exc(self): - """Prepare folder for analysis in HPC - Copies template selected as input - Copies RAW data with sequencing id as fastq file names - Creates samples_id.txt - - Args: - - Returns: - - """ - - # copy template folder and subfolders in output folder - shutil.copytree(self.template, self.output_folder) - # create the 00_reads folder - os.makedirs(self.linked_sample_folder, exist_ok=True) - # collect json with all validated samples - samples_data, join_validate = self.join_valid_items() - - # Check for possible duplicates - # Extract the sequencing_sample_id from the list of dictionaries - sample_ids = [item["sequencing_sample_id"] for item in samples_data] - - # Use Counter to count the occurrences of each sequencing_sample_id - id_counts = Counter(sample_ids) - - # Find the sequencing_sample_id values that are duplicated (count > 1) - duplicates = [sample_id for sample_id, count in id_counts.items() if count > 1] - - if duplicates: - log.error(f"There are duplicated samples in your batch: {duplicates}") - stderr.print( - f"[red] There are duplicated samples in your batch: {duplicates}. Please handle manually" - ) - sys.exit() - - # iterate over the sample_data to copy the fastq files in the output folder - file_errors = [] - samp_errors = [] - copied_samples = 0 - if len(samples_data) == 0: - stderr.print("[yellow] No samples were found. Deleting analysis folder") - shutil.rmtree(self.analysis_folder) - sys.exit(0) - log.info("Samples to copy %s", len(samples_data)) + log.info("Found a total of %s samples", str(len(join_validate))) + stderr.print(f"Found a total of {len(join_validate)} samples") + return join_validate, latest_date + + def copy_process(self, samples_data, output_folder): + samp_errors = {} + links_folder = os.path.join( + output_folder, self.analysis_folder, self.linked_sample_folder + ) + os.makedirs(links_folder, exist_ok=True) for sample in samples_data: + sample_id = sample["sequencing_sample_id"] # fetch the file extension ext_found = re.match(r".*(fastq.*|bam)", sample["r1_fastq_filepath"]) + if not ext_found: + log.error("No valid file extension found for %s", sample_id) + samp_errors[sample_id].append(sample["r1_fastq_filepath"]) + continue ext = ext_found.group(1) - sequencing_r1_sample_id = sample["sequencing_sample_id"] + "_R1." + ext - # copy r1 sequencing file into the output folder + seq_r1_sample_id = sample["sequencing_sample_id"] + "_R1." + ext + # copy r1 sequencing file into the output folder self.analysis_folder sample_raw_r1 = os.path.join( - self.analysis_folder, self.copied_sample_folder, sequencing_r1_sample_id + output_folder, self.copied_sample_folder, seq_r1_sample_id ) log.info("Copying sample %s", sample) stderr.print("[blue] Copying sample: ", sample["sequencing_sample_id"]) try: shutil.copy(sample["r1_fastq_filepath"], sample_raw_r1) # create simlink for the r1 - r1_link_path = os.path.join( - self.linked_sample_folder, sequencing_r1_sample_id - ) - r1_link_path_ori = os.path.join("../../RAW", sequencing_r1_sample_id) + r1_link_path = os.path.join(links_folder, seq_r1_sample_id) + r1_link_path_ori = os.path.join("../../RAW", seq_r1_sample_id) os.symlink(r1_link_path_ori, r1_link_path) except FileNotFoundError as e: log.error("File not found %s", e) - file_errors.append(sample["r1_fastq_filepath"]) + samp_errors[sample_id] = [] + samp_errors[sample_id].append(sample["r1_fastq_filepath"]) if "r2_fastq_filepath" in sample: - file_errors.append(sample["r2_fastq_filepath"]) - samp_errors.append(sample["sequencing_sample_id"]) + samp_errors[sample_id].append(sample["r2_fastq_filepath"]) continue - copied_samples += 1 # check if there is a r2 file if "r2_fastq_filepath" in sample: - sequencing_r2_sample_id = sample["sequencing_sample_id"] + "_R2." + ext + seq_r2_sample_id = sample["sequencing_sample_id"] + "_R2." + ext sample_raw_r2 = os.path.join( - self.analysis_folder, + output_folder, self.copied_sample_folder, - sequencing_r2_sample_id, + seq_r2_sample_id, ) - try: shutil.copy(sample["r2_fastq_filepath"], sample_raw_r2) - r2_link_path = os.path.join( - self.linked_sample_folder, sequencing_r2_sample_id - ) - r2_link_path_ori = os.path.join( - "../../RAW", sequencing_r2_sample_id - ) + r2_link_path = os.path.join(links_folder, seq_r2_sample_id) + r2_link_path_ori = os.path.join("../../RAW", seq_r2_sample_id) os.symlink(r2_link_path_ori, r2_link_path) except FileNotFoundError as e: log.error("File not found %s", e) - file_errors.append(sample["r2_fastq_filepath"]) - samp_errors.append(sample["sequencing_sample_id"]) + if not samp_errors.get(sample_id): + samp_errors[sample_id] = [] + samp_errors[sample_id].append(sample["r2_fastq_filepath"]) continue if len(samp_errors) > 0: stderr.print( "[red]Some files were not found. Unable to copy files from", "[red]" + str(len(samp_errors)) + " samples", ) - msg = "Do you want to delete analysis folder? Y/N" + msg = f"Do you want to delete analysis folder {output_folder}? Y/N" confirmation = relecov_tools.utils.prompt_yn_question(msg) if confirmation: - shutil.rmtree(self.output_folder) - sys.exit(1) + shutil.rmtree(output_folder) + return samp_errors - final_valid_samples = [ - x for x in join_validate if x.get("sequencing_sample_id") not in samp_errors - ] - sample_ids = [i for i in sample_ids if i not in samp_errors] - # print samples_id file - stderr.print(f"[blue]Generating sample_id.txt file in {self.analysis_folder}") - with open(os.path.join(self.analysis_folder, "samples_id.txt"), "w") as f: - for sample_id in sample_ids: - f.write(f"{sample_id}\n") + def create_samples_data(self, json_data): + samples_data = [] + for item in json_data: + sample = {} + sample["sequencing_sample_id"] = item["sequencing_sample_id"] + sample["r1_fastq_filepath"] = os.path.join( + item["r1_fastq_filepath"], item["sequence_file_R1_fastq"] + ) + if "r2_fastq_filepath" in item: + sample["r2_fastq_filepath"] = os.path.join( + item["r2_fastq_filepath"], item["sequence_file_R2_fastq"] + ) + samples_data.append(sample) + return samples_data - date_and_time = datetime.datetime.today().strftime("%Y%m%d%-H%M%S") - json_filename = os.path.join( - self.output_folder, - self.doc_folder, - f"{date_and_time}_validate_batch.json", - ) - relecov_tools.utils.write_json_fo_file(final_valid_samples, json_filename) - stderr.print("[green] Samples copied: ", copied_samples) - log.info("[blue]Successfully created pipeline folder. Ready to launch ") - stderr.print("[blue]Successfully created pipeline folder. Ready to launch") + def split_data_by_key(self, json_data, keylist): + """Split a given json data into different lists based on a given list of keys. + From a single list of samples (dicts), the output will now be a list of lists + where each new list is a subset of the original samples with the same values + for the given list of keys + + Args: + json_data (list(dict)): List of dictionaries, one for each sample + keylist (list(str)): List of keys within the given dictionaries to + split data. + + Returns: + + """ + if not keylist: + return [json_data] + + json_split_by_key = {} + new_key = keylist[0] + next_keys = keylist[1:] + + json_uniq_vals = frozenset([x.get(new_key) for x in json_data]) + for val in json_uniq_vals: + grouped_samples = [x for x in json_data if x.get(new_key) == val] + json_split_by_key[val] = grouped_samples + + list_of_jsons_by_key = [] + for group in json_split_by_key.values(): + list_of_jsons_by_key.extend(self.split_data_by_key(group, next_keys)) + return list_of_jsons_by_key + + def pipeline_exc(self): + """Prepare folder for analysis in HPC + Copies template selected as input + Copies RAW data with sequencing id as fastq file names + Creates samples_id.txt + + Args: + + Returns: + + """ + # collect json with all validated samples + join_validate, latest_date = self.join_valid_items() + if len(join_validate) == 0: + stderr.print(f"[yellow]No samples were found. Aborting") + sys.exit(0) + keys_to_split = ["host_gender", "enrichment_panel_version"] + stderr.print(f"[blue]Splitting samples based on {keys_to_split}...") + json_split_by_panel = self.split_data_by_key(join_validate, keys_to_split) + stderr.print(f"[blue]Data splitted into {len(json_split_by_panel)} groups") + # iterate over the sample_data to copy the fastq files in the output folder + global_samp_errors = {} + for idx, list_of_samples in enumerate(json_split_by_panel, start=1): + group_tag = f"{latest_date}_PANEL{idx:02d}" + group_outfolder = os.path.join( + self.output_folder, self.out_folder_namevar % group_tag + ) + if os.path.exists(group_outfolder): + msg = f"Analysis folder {group_outfolder} already exists and it will be deleted. Do you want to continue? Y/N" + confirmation = relecov_tools.utils.prompt_yn_question(msg) + if confirmation is False: + continue + shutil.rmtree(group_outfolder) + samples_data = self.create_samples_data(list_of_samples) + # Create a folder for the group of samples and copy the files there + log.info("Creating folder for group %s", group_tag) + stderr.print(f"[blue]Creating folder for group {group_tag}") + # copy template folder and subfolders in output folder + shutil.copytree(self.template, group_outfolder) + # Check for possible duplicates + log.info("Samples to copy %s", len(samples_data)) + # Extract the sequencing_sample_id from the list of dictionaries + sample_ids = [item["sequencing_sample_id"] for item in samples_data] + # Use Counter to count the occurrences of each sequencing_sample_id + id_counts = Counter(sample_ids) + # Find the sequencing_sample_id values that are duplicated (count > 1) + duplicates = [ + sample_id for sample_id, count in id_counts.items() if count > 1 + ] + if duplicates: + log.error( + "There are duplicated samples in group %s: %s" + % ({group_tag}, {duplicates}) + ) + stderr.print( + f"[red] There are duplicated samples in group {group_tag}: {duplicates}. Please handle manually" + ) + continue + + samp_errors = self.copy_process(samples_data, group_outfolder) + global_samp_errors[group_tag] = samp_errors + samples_copied = len(list_of_samples) - len(samp_errors) + stderr.print( + f"[green]Group {group_tag}: {samples_copied} samples copied out of {len(list_of_samples)}" + ) + final_valid_samples = [ + x + for x in join_validate + if x.get("sequencing_sample_id") not in samp_errors + ] + sample_ids = [i for i in sample_ids if i not in samp_errors] + group_analysis_folder = os.path.join(group_outfolder, self.analysis_folder) + # print samples_id file + stderr.print( + f"[blue]Generating sample_id.txt file in {group_analysis_folder}" + ) + with open(os.path.join(group_analysis_folder, "samples_id.txt"), "w") as f: + for sample_id in sample_ids: + f.write(f"{sample_id}\n") + json_filename = os.path.join( + group_outfolder, + self.doc_folder, + f"{group_tag}_validate_batch.json", + ) + relecov_tools.utils.write_json_fo_file(final_valid_samples, json_filename) + log.info("[blue]Successfully created pipeline folder. Ready to launch") + stderr.print( + f"[blue]Successfully created folder for {group_tag}. Ready to launch" + ) + for group, samples in global_samp_errors.items(): + if not samples: + continue + log.error("Group %s received error for samples: %s" % (group, samples)) + else: + stderr.print("[green]All samples were copied successfully!!") + log.info("Finished execution") + stderr.print("Finished execution") return From 2c7e080312a993d7d685d6eb4f8065dc2f2497e7 Mon Sep 17 00:00:00 2001 From: Shettland Date: Fri, 11 Oct 2024 14:37:56 +0200 Subject: [PATCH 80/83] Now splits data based on enrichment_panel. Linting --- relecov_tools/pipeline_manager.py | 3 +-- 1 file changed, 1 insertion(+), 2 deletions(-) diff --git a/relecov_tools/pipeline_manager.py b/relecov_tools/pipeline_manager.py index b78b8477..f69ba20b 100644 --- a/relecov_tools/pipeline_manager.py +++ b/relecov_tools/pipeline_manager.py @@ -5,7 +5,6 @@ import re import shutil import sys -import re from collections import Counter import rich.console @@ -313,7 +312,7 @@ def pipeline_exc(self): # collect json with all validated samples join_validate, latest_date = self.join_valid_items() if len(join_validate) == 0: - stderr.print(f"[yellow]No samples were found. Aborting") + stderr.print("[yellow]No samples were found. Aborting") sys.exit(0) keys_to_split = ["host_gender", "enrichment_panel_version"] stderr.print(f"[blue]Splitting samples based on {keys_to_split}...") From 0df5848eea31eca1a73b494e7c2fcd0f791d2888 Mon Sep 17 00:00:00 2001 From: Shettland Date: Fri, 11 Oct 2024 14:51:23 +0200 Subject: [PATCH 81/83] Updated CHANGELOG.md pre-release 1.2.0 --- CHANGELOG.md | 15 +++++++++++++-- 1 file changed, 13 insertions(+), 2 deletions(-) diff --git a/CHANGELOG.md b/CHANGELOG.md index d71fb328..fd20a0a1 100755 --- a/CHANGELOG.md +++ b/CHANGELOG.md @@ -4,7 +4,7 @@ All notable changes to this project will be documented in this file. The format is based on [Keep a Changelog](https://keepachangelog.com/en/1.0.0/), and this project adheres to [Semantic Versioning](https://semver.org/spec/v2.0.0.html). -## [1.2.0] - 2024-09-0X : https://github.com/BU-ISCIII/relecov-tools/releases/tag/1.2.0 +## [1.2.0] - 2024-10-11 : https://github.com/BU-ISCIII/relecov-tools/releases/tag/1.2.0 ### Credits @@ -16,7 +16,8 @@ Code contributions to the release: ### Modules -- Included wrapper module to launch download, read-lab-metadata and validate processes sequentially +- Included wrapper module to launch download, read-lab-metadata and validate processes sequentially [#322](https://github.com/BU-ISCIII/relecov-tools/pull/322) +- Changed launch-pipeline name for pipeline-manager when tools are used via CLI [#324](https://github.com/BU-ISCIII/relecov-tools/pull/324) #### Added enhancements @@ -29,11 +30,18 @@ Code contributions to the release: - More accurate cleaning process, skipping only sequencing files instead of whole folder [#321](https://github.com/BU-ISCIII/relecov-tools/pull/321) - Now single logs summaries are also created for each folder during download [#321](https://github.com/BU-ISCIII/relecov-tools/pull/321) - Introduced handling for missing/dup files and more accurate information in prompt for pipeline_manager [#321](https://github.com/BU-ISCIII/relecov-tools/pull/321) +- Included excel resize, brackets removal in messages and handled exceptions in log_summary.py [#322](https://github.com/BU-ISCIII/relecov-tools/pull/322) +- Included processed batchs and samples in read-bioinfo-metadata log summary [#324](https://github.com/BU-ISCIII/relecov-tools/pull/324) +- When no samples_data.json is given, read-lab-metadata now creates a new one [#324](https://github.com/BU-ISCIII/relecov-tools/pull/324) +- Handling for missing sample ids in read-lab-metadata [#324](https://github.com/BU-ISCIII/relecov-tools/pull/324) +- Better logging for download, read-lab-metadata and wrapper [#324](https://github.com/BU-ISCIII/relecov-tools/pull/324) #### Fixes - Fixed wrong city name in relecov_tools/conf/laboratory_address.json [#320](https://github.com/BU-ISCIII/relecov-tools/pull/320) - Fixed wrong single-paired layout detection in metadata due to Capital letters [#321](https://github.com/BU-ISCIII/relecov-tools/pull/321) +- Error handling in merge_logs() and create_logs_excel() methods for log_summary.py [#322](https://github.com/BU-ISCIII/relecov-tools/pull/322) +- Included handling of multiple empty rows in metadata xlsx file [#322](https://github.com/BU-ISCIII/relecov-tools/pull/322) #### Changed @@ -44,6 +52,9 @@ Code contributions to the release: - Moved concurrency to whole workflow instead of each step in test_sftp-handle.yml [#320](https://github.com/BU-ISCIII/relecov-tools/pull/320) - Updated test_sftp-handle.yml testing datasets [#320](https://github.com/BU-ISCIII/relecov-tools/pull/320) - Now download skips folders containing "invalid_samples" in its name [#321](https://github.com/BU-ISCIII/relecov-tools/pull/321) +- read-lab-metadata: Some warnings now include label. Also removed trailing spaces [#322](https://github.com/BU-ISCIII/relecov-tools/pull/322) +- Renamed launch-pipeline for pipeline-manager and updated keys in configuration.json [#324](https://github.com/BU-ISCIII/relecov-tools/pull/324) +- Pipeline manager now splits data based on enrichment_panel and version. One folder for each group [#324](https://github.com/BU-ISCIII/relecov-tools/pull/324) #### Removed From 8f099b6b39ddba7dde31562652e1beee9c1d9556 Mon Sep 17 00:00:00 2001 From: Shettland Date: Fri, 11 Oct 2024 16:04:35 +0200 Subject: [PATCH 82/83] Moved delete folder prompt. Included docstrings --- relecov_tools/pipeline_manager.py | 61 ++++++++++++++++++++++--------- 1 file changed, 43 insertions(+), 18 deletions(-) diff --git a/relecov_tools/pipeline_manager.py b/relecov_tools/pipeline_manager.py index f69ba20b..8256dfa3 100644 --- a/relecov_tools/pipeline_manager.py +++ b/relecov_tools/pipeline_manager.py @@ -99,19 +99,14 @@ def __init__( self.doc_folder = config_data["doc_folder"] def join_valid_items(self): - """Join validated metadata for the latest batches downloaded + """Join validated metadata for the latest batches downloaded into a single one Args: Returns: - sample_data: list(dict) - [ - { - "sequencing_sample_id":XXXX, - "r1_fastq_filepath": XXXX, - "r2_fastq_filepath":XXXX - } - ] + join_validate (list(dict)): List of dictionaries containing all the samples + found in each validated_lab_metadata.json form the scanned folders + latest_date (str): Latest batch date found in the scanned folder """ def get_latest_lab_folder(self): @@ -188,6 +183,18 @@ def get_latest_lab_folder(self): return join_validate, latest_date def copy_process(self, samples_data, output_folder): + """Copies all the necessary samples files in the given samples_data list + to the output folder. Also creates symbolic links into the link folder + given in config_file. + + Args: + samples_data (list(dict)): samples_data from self.create_samples_data() + output_folder (str): Destination folder to copy files + + Returns: + samp_errors (dict): Dictionary where keys are sequencing_sample_id and values + the files that received an error while trying to copy. + """ samp_errors = {} links_folder = os.path.join( output_folder, self.analysis_folder, self.linked_sample_folder @@ -241,18 +248,26 @@ def copy_process(self, samples_data, output_folder): samp_errors[sample_id] = [] samp_errors[sample_id].append(sample["r2_fastq_filepath"]) continue - if len(samp_errors) > 0: - stderr.print( - "[red]Some files were not found. Unable to copy files from", - "[red]" + str(len(samp_errors)) + " samples", - ) - msg = f"Do you want to delete analysis folder {output_folder}? Y/N" - confirmation = relecov_tools.utils.prompt_yn_question(msg) - if confirmation: - shutil.rmtree(output_folder) return samp_errors def create_samples_data(self, json_data): + """Creates a copy of the json_data but only with relevant keys to copy files. + Here 'r1_fastq_filepath' is created joining the original 'r1_fastq_filepath' + and 'sequence_file_R1_fastq' fields. The same goes for 'r2_fastq_filepath' + + Args: + json_data (list(dict)): Samples metadata in a list of dictionaries + + Returns: + sample_data: list(dict) + [ + { + "sequencing_sample_id":XXXX, + "r1_fastq_filepath": XXXX, + "r2_fastq_filepath":XXXX + } + ] + """ samples_data = [] for item in json_data: sample = {} @@ -358,6 +373,16 @@ def pipeline_exc(self): continue samp_errors = self.copy_process(samples_data, group_outfolder) + if len(samp_errors) > 0: + stderr.print( + f"[red]Unable to copy files from {len(samp_errors)} samples in group {group_tag}" + ) + msg = f"Do you want to delete analysis folder {group_outfolder}? Y/N" + confirmation = relecov_tools.utils.prompt_yn_question(msg) + if confirmation: + shutil.rmtree(group_outfolder) + log.info(f"Folder {group_outfolder} removed") + continue global_samp_errors[group_tag] = samp_errors samples_copied = len(list_of_samples) - len(samp_errors) stderr.print( From 6ef3a10832bbd87c172335622084b296879df3b6 Mon Sep 17 00:00:00 2001 From: Shettland Date: Fri, 11 Oct 2024 16:05:45 +0200 Subject: [PATCH 83/83] Removed temporary changes. More logging --- relecov_tools/pipeline_manager.py | 20 ++++++++++++-------- 1 file changed, 12 insertions(+), 8 deletions(-) diff --git a/relecov_tools/pipeline_manager.py b/relecov_tools/pipeline_manager.py index 8256dfa3..b1549db0 100644 --- a/relecov_tools/pipeline_manager.py +++ b/relecov_tools/pipeline_manager.py @@ -163,7 +163,7 @@ def get_latest_lab_folder(self): log.info("Collecting samples for %s", lab_code) stderr.print("[blue] Collecting samples for ", lab_code) # check if laboratory folder is the latest date to process - if data_folder["date"] != datetime.date(2024, 9, 30): # latest_date: + if data_folder["date"] != latest_date: continue # fetch the validate file and get sample id and r1 and r2 file path validate_files = [ @@ -326,10 +326,11 @@ def pipeline_exc(self): """ # collect json with all validated samples join_validate, latest_date = self.join_valid_items() + latest_date = str(latest_date).replace("-", "") if len(join_validate) == 0: stderr.print("[yellow]No samples were found. Aborting") sys.exit(0) - keys_to_split = ["host_gender", "enrichment_panel_version"] + keys_to_split = ["enrichment_panel", "enrichment_panel_version"] stderr.print(f"[blue]Splitting samples based on {keys_to_split}...") json_split_by_panel = self.split_data_by_key(join_validate, keys_to_split) stderr.print(f"[blue]Data splitted into {len(json_split_by_panel)} groups") @@ -337,6 +338,8 @@ def pipeline_exc(self): global_samp_errors = {} for idx, list_of_samples in enumerate(json_split_by_panel, start=1): group_tag = f"{latest_date}_PANEL{idx:02d}" + log.info("Processing group %s", group_tag) + stderr.print(f"[blue]Processing group {group_tag}...") group_outfolder = os.path.join( self.output_folder, self.out_folder_namevar % group_tag ) @@ -346,6 +349,7 @@ def pipeline_exc(self): if confirmation is False: continue shutil.rmtree(group_outfolder) + log.info(f"Folder {group_outfolder} removed") samples_data = self.create_samples_data(list_of_samples) # Create a folder for the group of samples and copy the files there log.info("Creating folder for group %s", group_tag) @@ -390,7 +394,7 @@ def pipeline_exc(self): ) final_valid_samples = [ x - for x in join_validate + for x in list_of_samples if x.get("sequencing_sample_id") not in samp_errors ] sample_ids = [i for i in sample_ids if i not in samp_errors] @@ -412,11 +416,11 @@ def pipeline_exc(self): stderr.print( f"[blue]Successfully created folder for {group_tag}. Ready to launch" ) - for group, samples in global_samp_errors.items(): - if not samples: - continue - log.error("Group %s received error for samples: %s" % (group, samples)) - else: + for group, samples in global_samp_errors.items(): + if not samples: + continue + log.error("Group %s received error for samples: %s" % (group, samples)) + if not any(v for v in global_samp_errors.values()): stderr.print("[green]All samples were copied successfully!!") log.info("Finished execution") stderr.print("Finished execution")