FhG pKa model

This is a repository of the FhG-ITMP ADME models for pKa using the Czodorowski dataset.

• To test the model on a new data set, a dataset with ECFP4 fingerprints is required. Ensure that the columns are labelled with the prefix "ECFP4_" as shown below.

• An excel download of the prediction results is possible.