def testTokenizerDipoleMoment(self): # fold>> data = FileSnippets.dipoleMoment()+"\n" writeToTestFile(data) tokens = Dalton.tokenizeOutFile(testFilePath()) self.assertEqual(len(tokens), 1) self.assertEqual(tokens[0].__class__, Tokens.DipoleMomentToken)
def testDipoleMomentToken(self): # fold>> data = FileSnippets.dipoleMoment() writeToTestFile(data) reader = FileReader.FileReader(testFilePath()) start_pos = reader.currentPos() token = Tokens.DipoleMomentToken.match(reader) self.assertEqual(token.__class__, Tokens.DipoleMomentToken) self.assertEqual(reader.currentPos(), start_pos + 4) dipole = token.dipole() self.assertAlmostEqual(dipole, 3.141592)