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Attribute
AI Drug Discovery

DiffDock

DiffDock authors and contributors
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CategoryAI Drug Discovery
CompanyDiffDock authors and contributors
PriceSee project terms; compute costs may apply
StatusStatus not confirmed
AvailabilitySee project access and maintenance status
Last checked16/09/2026
FeaturesDiffusion-based protein-ligand docking, Input: Protein structure or sequence and ligand SMILES or structure, Output: Candidate binding poses and confidence scores
Entry typeResearch software / model
Access modePublic code / project terms
AI roleScientific machine learning
Input dataProtein structure or sequence and ligand SMILES or structure
Output dataCandidate binding poses and confidence scores
Licence conditionsReview the linked release, model weights, datasets and service terms separately
Commercial eligibilityNot independently confirmed
Compute requirementsConsult linked installation guidance; workload dependent
ValidationEvaluate on representative data; no clinical suitability established
TypeNot recorded
Intended useBiological and pharmaceutical research
CompatibilityNot recorded
LimitationsThe repository defaults to DiffDock-L; a docking pose is not evidence of binding affinity.
Evidence levelProject or provider documentation; no local performance benchmark