`MDPath `_ documentation =========================================================================== **MDPath** is a Python package designed to calculate and visualize allosteric communication pathways in proteins using molecular dynamics (MD) simulations. It employs mutual information calculations to identify connected residues and graph-building techniques to map out pathways between them. This documentation will guide you through the installation, usage, and functionalities of MDPath, providing detailed instructions and examples to help you explore protein dynamics and interactions effectively. .. toctree:: :maxdepth: 1 :caption: User Guide installation faq .. toctree:: :maxdepth: 1 :caption: MDPath running_mdpath mdpath_outputs running_mdpath_tools mdpath_visualization .. toctree:: :maxdepth: 1 :caption: API Docs mdpath_api .. toctree:: :maxdepth: 1 :caption: Contributing to MDPath developer_guide