def test_toSMILES(self):
sm = SmallMol(self.benzamidine_mol2)
assert (sm.toSMILES() == "NC(=[NH2+])C1=CC=CC=C1"
), "Failed with SMILES: {}".format(sm.toSMILES())
def test_toSMILES(self):
sm = SmallMol(self.benzamidine_mol2)
assert sm.toSMILES() == 'NC(=[NH2+])C1=CC=CC=C1', 'Failed with SMILES: {}'.format(sm.toSMILES())
