kevinkune/sbdd

•Updated over 2 years ago

structure-based drug design

Image

Machine learning & AI

265

kevinkune/sbdd repository overview

pytorch pyg torch-lightning autodock vina rdkit openbabel posecheck spyrmsd

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Image

Digest

sha256:5e14a4fb8…

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15.3 GB

Last updated

over 2 years ago

docker pull kevinkune/sbdd