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Agent Skills Guide

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.

📦 Install Skill

Command line install

Install directly with the `skills` CLI.

npx skills add majiayu000/claude-skill-registry-data/other/other/diffdock-k-dense-ai-claude-scientific-sk

Local download

Download only this skill directory.

Download diffdock only
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