Skills › Research & 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.
Tools: claude-code,cursor,gemini-cli
Preview
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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
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# DiffDock: Mole
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This is a premium super-skill. The full, curated skill unlocks with membership.