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    6 repositories

    • met_annot_enhancer

      Public
      A set of script to proceed to metabolite annotation results enhancement using taxonomically and structurally informed processes
      Python
      •
      GNU General Public License v3.0
      •1•4•10•0•Updated Jun 6, 2024Jun 6, 2024

    • spectral_lib_matcher

      Public
      A script based on the matchms library allowing to calculate spectral similarity measures between two mgf (usually a query file and a library file).
      Python
      •
      GNU General Public License v3.0
      •0•9•5•0•Updated Oct 3, 2023Oct 3, 2023

    • spectral_lib_builder

      Public
      Python
      •0•0•2•0•Updated Oct 3, 2023Oct 3, 2023

    • pf_1600_datanote

      Public
      This repository gathers scripts used for the paper "Open and re-usable annotated mass spectrometry dataset of a chemodiverse collection of 1,600 plant extracts."
      metabolomicsbiodiversitynatural-products
      Python
      •
      GNU Affero General Public License v3.0
      •2•8•0•0•Updated Jul 24, 2023Jul 24, 2023

    • memo

      Public
      Ms2 basEd saMple vectOrization (memo) package
      Jupyter Notebook
      •
      GNU General Public License v3.0
      •0•17•4•0•Updated Jun 13, 2023Jun 13, 2023

    • memo_publication_examples

      Public
      Examples of MEMO application used for the article
      HTML
      •
      GNU General Public License v3.0
      •1•0•0•0•Updated Oct 7, 2022Oct 7, 2022