public void NormaliseHetroAt2()
{
int[] cycle = new int[] { 3, 2, 1, 4, 5, 3 };
int[] contr = new int[] { 1, 1, 1, 1, 1, 1 };
contr[cycle[2]] = 2;
Assert.IsTrue(MmffAromaticTypeMapping.NormaliseCycle(cycle, contr));
Assert.IsTrue(Compares.AreDeepEqual(new int[] { 1, 4, 5, 3, 2, 1 }, cycle));
}
public void NormaliseNoHetro()
{
int[] cycle = new int[] { 3, 2, 1, 4, 5, 3 };
int[] contr = new int[] { 1, 1, 1, 1, 1, 1 };
Assert.IsFalse(MmffAromaticTypeMapping.NormaliseCycle(cycle, contr));
}
