deepchem
Molecular machine learning toolkit. Property prediction (ADMET, toxicity), GNNs (GCN, MPNN), MoleculeNet benchmarks, pretrained models, featurization, for drug discovery ML.
- Industry
- data-science
- License
- Unverified
- Source repo
- FreedomIntelligence/OpenClaw-Medical-Skills · ★ 2,841
- Source file
- skills/deepchem/SKILL.md
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