Name | Version | Summary | date |
---|---|---|---|
docko | 0.1.2 | None | 2025-02-08 02:58:30 |
dockstring | 0.3.4 | Package for easy ligand preparation and docking with AutoDock Vina against a highly-curated selection of 58 protein targets. One of the three components of the DOCKSTRING bundle (package, dataset, and benchmark tasks). | 2024-10-25 14:04:18 |
luna | 0.13.1 | LUNA: drug discovery toolkit | 2023-07-12 12:22:10 |
ccmap | 4.0.2 | A C implementation of a mesh based atomic pairwise distance computating engine, with docking pose generation capabilities and fast solvant accessible surface estimation | 2023-01-12 18:42:59 |
pycaverdock | 1.2.0 | Python API for CaverDock | 2022-12-17 09:51:07 |
hour | day | week | total |
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73 | 2103 | 9814 | 296280 |