scikit-fingerprints/ASAP_OpenADMET_KSOL

ASAP-OpenADMET KSOL ASAP_OpenADMET_KSOL dataset from the ASAP Discovery-OpenADMET Antiviral Drug Discovery Challenge [1] [2] [3]. It is intended to be used through scikit-fingerprints library. The task is to predict KSOL (kinetic solubility in uM) of molecules. Characteristic Description Tasks 1 Task type regression Total samples 477 Recommended split time Recommended metric MAE References [1] ASAP Discovery "ASAP Discovery x OpenADMET… See the full description on the dataset page: https://huggingface.co/datasets/scikit-fingerprints/ASAP_OpenADMET_KSOL.