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 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/diffdock

Source

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

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

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