Agent Skills: torchdrug

Graph-based drug discovery toolkit. Molecular property prediction (ADMET), protein modeling, knowledge graph reasoning, molecular generation, retrosynthesis, GNNs (GIN, GAT, SchNet), 40+ datasets, for PyTorch-based ML on molecules, proteins, and biomedical graphs.

ID: obinopaul/agents-backend/torchdrug

Install this agent skill to your local

npx skills add obinopaul/agents-backend --skill torchdrug

Skill Files

The files that make up torchdrug.

Download Skill

More agent skills