scikit-fingerprints/ExpansionRx_OpenADMET_MPPB

ExpansionRx-OpenADMET MPPB MPPB dataset from the ExpansionRx-OpenADMET Blind Challenge [1] [2]. It is intended to be used through scikit-fingerprints library. The task is to predict MPPB of molecules. Characteristic Description Tasks 1 Task type regression Total samples 1756 Recommended split time Recommended metric MAE References [1] OpenADMET team "Announcement 1: ExpansionRx-OpenADMET Blind Challenge"… See the full description on the dataset page: https://huggingface.co/datasets/scikit-fingerprints/ExpansionRx_OpenADMET_MPPB.