unidock
A GPU-accelerated molecular docking program
A GPU-accelerated molecular docking program
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Uni-Dock is a GPU-accelerated molecular docking program developed by DP Technology. It supports various scoring functions including vina, vinardo, and ad4. Uni-Dock achieves more than 1000-fold speed-up on V100 GPU with high-accuracy, compared with the AutoDock Vina running in single CPU core. The paper has been accepted by JCTC (doi: 10.1021/acs.jctc.2c01145).
Summary
A GPU-accelerated molecular docking program
Last Updated
Jan 25, 2025 at 15:47
License
LGPL-3.0-only
Supported Platforms
GitHub Repository
https://github.com/dptech-corp/Uni-DockDocumentation
https://github.com/dptech-corp/Uni-Dock