Internal coordinates =================================== Zmat ------------- The :class:`~chemcoord.Zmat` class which is used to represent a molecule in non redundant, internal coordinates. .. currentmodule:: chemcoord .. autosummary:: :toctree: src_Zmat ~Zmat zmat_functions --------------- A collection of functions operating on instances of :class:`~chemcoord.Zmat`. .. currentmodule:: chemcoord.zmat_functions .. rubric:: Functions .. autosummary:: :toctree: src_zmat_functions ~apply_grad_cartesian_tensor .. rubric:: Contextmanagers .. autosummary:: :toctree: src_zmat_functions ~DummyManipulation ~TestOperators ~PureInternalMovement ~CleanDihedralOrientation