Skill

SkillsResearch & Science › Bioinformatics & life science

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.

Premiumrisk: low
molecular-dockingdiffdockdiffusion-modeldrug-discoveryprotein-ligandvirtual-screeningbinding-posestructure-based-designebizapple-super-skill

Tools: claude-code,cursor,gemini-cli

Preview

— name: diffdock description: 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. license: MIT tier: premium super_skill: true merged_from: [639, 884] domain: Research & Science subcategory: Bioinformatics & life science tags: [molecular-docking, diffdock, diffusion-model, drug-discovery, protein-ligand, virtual-screening, binding-pose, structure-based-design, python] tools: [claude-code, cursor, gemini-cli] risk: safe source: community (K-Dense Inc. / davila7) authored_by: ebizapple (AI-kuratert super-skill) date_curated: 2026-07-03 — # DiffDock: Mole …

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