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Popular GitHub Repositories for Molecular Docking

Discover the most popular open-source projects and tools related to Molecular Docking, and stay updated with the latest development trends and innovations.

DockStream

astrazeneca

DockStream: A Docking Wrapper to Enhance De Novo Molecular Design

116

3周前

Protenix Dock

molecular-docking

An accurate and trainable end-to-end protein-ligand docking framework

1周前

Uni 3DAR

3d-models

Implementation of paper "Uni-3DAR: Unified 3D Generation and Understanding via Autoregression on Compressed Spatial Tokens"

1周前

DiffDock Pocket

computational-biology

Implementation of DiffDock-Pocket: Diffusion for Pocket-Level Docking with Side Chain Flexibility

2周前