Code - zincware/MDSuite

Branch: main(View all)

Name	Lines of code	Maintainability	Test coverage
docs/source/_modules/mdsuite.utils.database.rst
docs/source/_modules/mdsuite.utils.exceptions.rst
docs/source/_modules/mdsuite.utils.helpers.rst
docs/source/_modules/mdsuite.utils.linalg.rst
docs/source/_modules/mdsuite.utils.meta_functions.rst
docs/source/_modules/mdsuite.utils.molecule.rst
docs/source/_modules/mdsuite.utils.neighbour_list.rst
docs/source/_modules/mdsuite.utils.report_computer_characteristics.rst
docs/source/_modules/mdsuite.utils.rst
docs/source/_modules/mdsuite.utils.scale_functions.rst
docs/source/_modules/mdsuite.utils.tensor_flow.helpers.rst
docs/source/_modules/mdsuite.utils.tensor_flow.layers.rst
docs/source/_modules/mdsuite.utils.tensor_flow.rst
docs/source/_modules/mdsuite.utils.testing.rst
docs/source/_modules/mdsuite.utils.units.rst
docs/source/_modules/mdsuite.visualizer.d2_data_visualization.rst
docs/source/_modules/mdsuite.visualizer.d3_data_visualizer.rst
docs/source/_modules/mdsuite.visualizer.rst
docs/source/_modules/mdsuite.visualizer.znvis_visualizer.rst
docs/source/_modules/modules.rst
docs/source/_modules/setup.rst
docs/source/_notebooks/Mapping_Molecules.nblink
docs/source/_notebooks/Molten_salt_Comparison.nblink
docs/source/_notebooks/NaCl_walkthrough.nblink
docs/source/_static/environment.yml
docs/source/_static/style.css
docs/source/_templates/layout.html
docs/source/_theory/autocorrelation_in_mdsuite.rst
docs/source/_theory/coordination_numbers.rst
docs/source/_theory/diffusion_coefficients.rst
docs/source/_theory/einstein_calculations.rst
docs/source/_theory/ensemble_average.rst
docs/source/_theory/fluctuation_dissipation_theorem.rst
docs/source/_theory/green_kubo_relations.rst
docs/source/_theory/hdf5_data_structure.rst
docs/source/_theory/ionic_conductivity.rst
docs/source/_theory/isothermal_compressibility.rst
docs/source/_theory/kirkwood_buff_integrals.rst
docs/source/_theory/onsager_coefficients_and_dynamics_in_md_simulations.rst
docs/source/_theory/phonon_spectrum.rst
docs/source/_theory/potential_of_mean_force.rst
docs/source/_theory/radial_distribution_function.rst
docs/source/_theory/structure_factor.rst
docs/source/_theory/tensor_operations_in_mdsuite.rst
docs/source/_theory/thermal_conductivity.rst
docs/source/_theory/viscosity.rst
docs/source/_usage/convolution.rst
docs/source/_usage/coordination_number_calculation.rst
docs/source/_usage/file_read.rst
docs/source/_usage/lammps_trajectory_files.rst