public void Opposite2()
{
Graph g = Graph.FromSmiles("F\\C=C\\F");
Assert.AreEqual(
Configuration.ConfigurationDoubleBond.Opposite,
BondBasedConfiguration.ConfigurationOf(g, 0, 1, 2, 3));
}
public void Together2()
{
Graph g = Graph.FromSmiles("F\\C=C/F");
Assert.AreEqual(
Configuration.ConfigurationDoubleBond.Together,
BondBasedConfiguration.ConfigurationOf(g, 0, 1, 2, 3));
}
public void NonDoubleBond()
{
Graph g = Graph.FromSmiles("CCCC");
BondBasedConfiguration.ConfigurationOf(g, 0, 1, 2, 3);
}