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DrugDesign Data Analysis
Module of the DrugDesign project responsible for loading and pre-processing data from ChEMBL and PubChem
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Namespaces | |
namespace | characteristics |
Functions | |
None | characteristics.FilterDownloadedToxicityByCharacteristics (str unit_type, str charact_1, str charact_2, str charact_3, str|None charact_4=None) |
list[str] | characteristics.GetMolfilesFromCIDs (list[str] cids, float|None sleep_time=toxicity_config["sleep_time"]) |