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

by ricable· Repository·other

Run in AgentArea Browse All Skills

Also installable via skills CLI

npx skills add ricable/ultimate-ai-agent/sources/ricable/claude-scientific-skills/scientific-skills/torchdrug

Source

Repo:github.com/ricable/ultimate-ai-agent

Path:sources/ricable/claude-scientific-skills/scientific-skills/torchdrug/SKILL.md(main)

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