Python get_connections示例

示例#1

文件： test_utils.py 项目： crcollins/molml

 def test_get_connections_disjoint(self):
     coords2 = numpy.array(COORDS) + 1
     res = get_connections(ELEMENTS, COORDS, ELEMENTS, coords2)
     expected = {
         0: {4: '1'},
         1: {0: '1', 4: '1'},
         2: {4: '1'},
         3: {},
         4: {}
     }
     self.assertEqual(res, expected)

示例#2

文件： test_utils.py 项目： alvarovm/molml

 def test_get_connections(self):
     res = get_connections(ELEMENTS, COORDS)
     self.assertEqual(res, CONNECTIONS)

示例#3

文件： test_utils.py 项目： crcollins/molml

 def test_get_connections(self):
     res = get_connections(ELEMENTS, COORDS)
     self.assertEqual(res, CONNECTIONS)