scikit-fingerprints/Biogen_ADME_RLM_CLint

Biogen ADME RLM CLint Biogen_ADME_RLM_CLint dataset from the Biogen ADME benchmark [1]. It is intended to be used through scikit-fingerprints library. The task is to predict log10 of rat liver microsomal intrinsic clearance (RLM CLint, in mL/min/kg) of molecules. Characteristic Description Tasks 1 Task type regression Total samples 3054 Recommended split time Recommended metric MAE References [1] Fang, Cheng, et al. "Prospective Validation… See the full description on the dataset page: https://huggingface.co/datasets/scikit-fingerprints/Biogen_ADME_RLM_CLint.