.. dafed documentation master file, created by sphinx-quickstart on Tue Jan 7 14:51:25 2020. You can adapt this file completely to your liking, but it should at least contain the root `toctree` directive. MolStrucClassifier index page ============================================================================== .. toctree:: :maxdepth: 2 :caption: Contents: Installation ----------------------------- .. toctree:: :maxdepth: 2 Install Symmetry Function code (molvec_lib) -------------------------------------- .. toctree:: :maxdepth: 2 SymmetryFunction LAMMPS atom style (USER-ATOM-VEC-FULL2) ---------------------------------------- .. toctree:: :maxdepth: 2 FULL2 Using symmetry function in Lammps -------------------------------------- .. toctree:: :maxdepth: 2 :glob: How_to_use How to prepare data file using Ovito -------------------------------------- .. toctree:: :maxdepth: 2 :glob: Ovito How to prepare files using moltemplate -------------------------------------- .. toctree:: :maxdepth: 2 :glob: moltemplate How to use Ogre -------------------------------------- .. toctree:: :maxdepth: 2 :glob: Ogre Neural Network classification (nn-fit) --------------------------------------- .. toctree:: :maxdepth: 2 :glob: neuralnet Parameter and Sample codes --------------------------------------- .. toctree:: :maxdepth: 1 :glob: Parameters Sample Indices and tables ================== * :ref:`genindex` * :ref:`modindex` * :ref:`search`