TMol documentation ================== .. container:: tmol-lead TMol provides all-atom scoring, packing, and minimization in PyTorch. Run batched calculations on CPU or CUDA and differentiate scores with respect to atom coordinates. Start with :doc:`quickstart` to load, score, repack, and relax a protein. Explore the :doc:`Glossary ` for visual explanations, or try the :doc:`score playground ` without installing anything. The tutorials contain runnable notebooks for more detailed workflows. .. toctree:: :maxdepth: 1 Installation Quickstart Glossary Tutorials API reference Contributing