gromacs/fileformats/blocks.py
def anumb_to_atom(self, anumb):
        '''Returns the atom object corresponding to an atom number'''

        assert isinstance(anumb, int), "anumb must be integer"

        if not self._anumb_to_atom:   # empty dictionary

            if self.atoms:
                for atom in self.atoms:
                    self._anumb_to_atom[atom.number] = atom
                return self._anumb_to_atom[anumb]
            else:
                self.logger("no atoms in the molecule")
                return False

        else:
            if anumb in self._anumb_to_atom:
                return self._anumb_to_atom[anumb]
            else:
                self.logger("no such atom number ({0:d}) in the molecule".format(anumb))
                return False
def anumb_to_atom(self, anumb):
        '''Returns the atom object corresponding to an atom number'''

        assert isinstance(anumb, int), "anumb must be integer"

        if not self._anumb_to_atom:   # empty dictionary

            if self.atoms:
                for atom in self.atoms:
                    self._anumb_to_atom[atom.number] = atom
                return self._anumb_to_atom[anumb]
            else:
                self.logger("no atoms in the molecule")
                return False

        else:
            if anumb in self._anumb_to_atom:
                return self._anumb_to_atom[anumb]
            else:
                self.logger("no such atom number ({0:d}) in the molecule".format(anumb))
                return False
Returns the atom object corresponding to an atom number