{ "domain": "life-health", "topics": [ "drug-discovery" ], "type": "algorithm", "benchmark": { "task": "Classify Ames mutagenicity from a SMILES string", "metric": { "name": "AUROC", "better": "higher" }, "baseline": { "name": "Top of the TDC leaderboard (ZairaChem)", "score": 0.871 } }, "source": { "key": "tdc-admet", "name": "Therapeutics Data Commons ADMET benchmark group", "url": "https://tdcommons.ai/benchmark/admet_group/21ames/", "id": "AMES", "curator": "Therapeutics Data Commons (Harvard)", "poser": "Xu et al.", "status": "open", "as_of": "2026-10-20", "catalog": "0521c19bbd38" } }