diffdock

Diffusion-based molecular docking. Predict protein-ligand binding poses from PDB/SMILES, confidence scores, virtual screening, for structure-based drug design. Not for affinity prediction.

by davila7· Repository·design

Run in AgentArea Browse All Skills

Also installable via skills CLI

npx skills add davila7/claude-code-templates/cli-tool/components/skills/scientific/diffdock

Source

Repo:SkillsMP + GitHub Raw

Path:cli-tool/components/skills/scientific/diffdock(main)

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