DiffDock
github.com/gcorso/diffdockDiffusion-based molecular docking achieving SOTA blind docking performance, treating ligand pose prediction as generative diffusion over SE(3), with DiffDock-L update for improved generalization (MIT CSAIL, ICLR 2023)
Sourced from
- GitHub — github.com/gcorso/diffdock
- Awesome AI for Science — github.com/gcorso/diffdock
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