.. _users_guide: User's Guide ============ This section describes how to use ``librascal`` for a few common tasks in atomistic machine learning, from calculating descriptors, to training and saving a potential energy surface model, to using that model to run molecular dynamics[1_]. Contents -------- .. toctree:: :maxdepth: 2 model_fitting loading_saving running_md .. [1] Disclaimer: This section is currently under construction. The most complete examples of how to use ``librascal`` are currently in the ``examples/`` directory of the main repository.