Binding Affinity Prediction Diffusion Models

There are 11 binding affinity prediction models tracked. 2 score above 50 (established tier). The highest-rated is gcorso/DiffDock at 53/100 with 1,454 stars.

Get all 11 projects as JSON

curl "https://pt-edge.onrender.com/api/v1/datasets/quality?domain=diffusion&subcategory=binding-affinity-prediction&limit=20"

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#	Model	Score	Tier	Stars	Language
1	gcorso/DiffDock Implementation of DiffDock: Diffusion Steps, Twists, and Turns for Molecular Docking	53	Established	1,454	Python
2	arneschneuing/DiffSBDD A Euclidean diffusion model for structure-based drug design.	52	Established	488	Python
3	gcorso/torsional-diffusion Implementation of Torsional Diffusion for Molecular Conformer Generation...	46	Emerging	281	Python
4	igashov/DiffLinker DiffLinker: Equivariant 3D-Conditional Diffusion Model for Molecular Linker Design	45	Emerging	371	Python
5	BioinfoMachineLearning/bio-diffusion A geometry-complete diffusion generative model (GCDM) for 3D molecule...	45	Emerging	233	Python
6	ketatam/DiffDock-PP Implementation of DiffDock-PP: Rigid Protein-Protein Docking with Diffusion...	38	Emerging	232	Python
7	AdrienC21/CCSD Combinatorial Complex Score-based Diffusion model using stochastic...	37	Emerging	10	Python
8	DeepGraphLearning/DiffPack Implementation of DiffPack: A Torsional Diffusion Model for Autoregressive...	35	Emerging	89	Python
9	jostorge/diffusion-hopping DiffHopp: A Graph Diffusion Model for Novel Drug Design via Scaffold Hopping	34	Emerging	36	Python
10	Dunni3/keypoint-diffusion A diffusion model for structure-based drug design with faster inference from...	32	Emerging	31	Python
11	kiharalab/DiffModeler DiffModeler: a diffusion model based protein complex structure modeling tool.	31	Emerging	58	Python

Comparisons in this category

DiffDock and DiffDock-PP (53 vs 38) DiffDock and DiffPack (53 vs 35) DiffSBDD and DiffLinker (52 vs 45) DiffSBDD and keypoint-diffusion (52 vs 32)