matmacore

• matmacore package
  • Submodules
  • matmacore.mol module
    • Mol
      • Mol.connectivity_matrix()
      • Mol.cp2k()
      • Mol.csv()
      • Mol.element_symbol()
      • Mol.gaussian()
      • Mol.gromacs()
      • Mol.orca()
    • Reaction
      • Reaction.combiner()
      • Reaction.create_mol_list()
      • Reaction.create_reaction_list()
      • Reaction.delta()
  • matmacore.plot module
    • Plot
      • Plot.cmap()
      • Plot.contour()
      • Plot.fes()
      • Plot.foo_plot()
      • Plot.multi_profile()
      • Plot.puckers_hist()
      • Plot.puckers_scatter()
      • Plot.rdf()
      • Plot.reaction_profile()
      • Plot.savefig()
      • Plot.scatter()
      • Plot.set_axes()
      • Plot.set_colors()
      • Plot.set_config()
      • Plot.trajectory()
  • matmacore.utilities module
    • get_distance()
    • hartree_to_kcal()
    • proper_minus()
    • read_coordinates()
  • Module contents