コード例 #1
0
        public void Together_torsion()
        {
            GeometricParity geometric = new DoubleBond3DParity(new Vector3(-4.6152, 0.3287, 0.5476),
                                                               new Vector3(-3.6042, 0.3501, -0.6139), new Vector3(-5.6414, 1.6608, 0.7013), new Vector3(-3.1478, 1.6935, -1.2129));

            Assert.AreEqual(Together, geometric.Parity);
        }
コード例 #2
0
        public void Opposite_torsion()
        {
            GeometricParity geometric = new DoubleBond3DParity(new Vector3(-4.6152, 0.3287, 0.5476),
                                                               new Vector3(-3.6042, 0.3501, -0.6139), new Vector3(-4.5881, -0.9142, 1.5627), new Vector3(-3.1478, 1.6935, -1.2129));

            Assert.AreEqual(Opposite, geometric.Parity);
        }
コード例 #3
0
        public void Together_endOn()
        {
            GeometricParity geometric = new DoubleBond3DParity(new Vector3(-4.3262, 0.3192, 0.6495),
                                                               new Vector3(-4.3206, 0.3724, -0.8896), new Vector3(-4.3214, 1.6255, 1.4651), new Vector3(-4.3101, 1.7319, -1.6131));

            Assert.AreEqual(Together, geometric.Parity);
        }
コード例 #4
0
        public void Opposite_endOn()
        {
            GeometricParity geometric = new DoubleBond3DParity(new Vector3(-4.3262, 0.3192, 0.6495),
                                                               new Vector3(-4.3206, 0.3724, -0.8896), new Vector3(-4.3367, -1.0402, 1.3729), new Vector3(-4.3101, 1.7319, -1.6131));

            Assert.AreEqual(Opposite, geometric.Parity);
        }
コード例 #5
0
        public void TogetherTest()
        {
            GeometricParity geometric = new DoubleBond3DParity(new Vector3(-4.6440, 0.4411, 0.5917),
                                                               new Vector3(-3.7159, 0.1090, -0.5916), new Vector3(-4.8954, 1.9087, 0.9848), new Vector3(-3.0392, 1.2445, -1.3818));

            Assert.AreEqual(Together, geometric.Parity);
        }
コード例 #6
0
        public void OppositeTest()
        {
            GeometricParity geometric = new DoubleBond3DParity(new Vector3(-4.6440, 0.4411, 0.5917),
                                                               new Vector3(-3.7159, 0.1090, -0.5916), new Vector3(-5.3207, -0.6945, 1.3818), new Vector3(-3.0392, 1.2445, -1.3818));

            Assert.AreEqual(Opposite, geometric.Parity);
        }