def _export_atom(self, toppar): if self.atom is not None: masses = [ rw.mass_reader(line) for line in self.atom ] toppar.mass = tp._merge_mass(masses, toppar.mass)
def _export_mass(self, toppar): if self.mass is not None: masses = [ rw.mass_reader(line) for line in self.mass ] merged = tp._merge_mass(masses, toppar.mass) if merged is not None: toppar.mass = merged