Model ===== The :class:`Model` class stores the structural data of your system, and as such it contains all :class:`Chain`, :class:`Molecule`, and :class:`Atom` instances of your system. It is possibly the most useful class for a user in practice, as the function that generates hybrid systems to be used in alchemical calculations (:func:`pmx.alchemy.mutate`) acts on this object. API Reference ------------- .. autoclass:: pmx.model.Model :exclude-members: com, writeFASTA, writePIR, writePDB, atomlistFromTop, append, assign_moltype, make_chains, make_residues .. rubric:: Methods .. autosummary:: read write renumber_residues renumber_atoms insert_residue insert_chain remove_atom remove_residue remove_chain replace_residue fetch_residue fetch_residues