def testAromaticCyclohexane(self): """ Test the Molecule.isAromatic() method for Cyclohexane. """ m = Molecule().fromSMILES('C1CCCCC1') isomers = m.generateResonanceIsomers() self.assertFalse(any(isomer.isAromatic() for isomer in isomers))
def testAromaticNaphthalene(self): """ Test the Molecule.isAromatic() method for Naphthalene. """ m = Molecule().fromSMILES('C12C(C=CC=C1)=CC=CC=2') isomers = m.generateResonanceIsomers() self.assertTrue(any(isomer.isAromatic() for isomer in isomers))