Reference XYZMolecule XYZMolecule.get_atoms

XYZMolecule.get_atoms

get_atoms(index)

Get an XYZCoord indexed

Parameters:

• index (MolIndex) –

  MolIndex can be a list of strings or integers or a single string or int that is either an atom number, species+species number (Molden style), or species.

Returns:

• list[XYZCoord] –

  Returns list of indexed atoms from XYZMolecule.atoms .