public void TestRemoveAcidicOxygen_IAminoAcid()
{
IAminoAcid glycine = builder.NewAminoAcid();
glycine.Add(CDK.SmilesParser.ParseSmiles("C(C(=O)O)N"));
Assert.AreEqual(5, glycine.Atoms.Count);
glycine.AddCTerminus(glycine.Atoms[1]);
AminoAcidManipulator.RemoveAcidicOxygen(glycine);
Assert.AreEqual(4, glycine.Atoms.Count);
}
public void TestAddAcidicOxygen_IAminoAcid()
{
// FIXME: I think this is the proper test, but it currently fails
IAminoAcid glycine = builder.NewAminoAcid();
glycine.Add(CDK.SmilesParser.ParseSmiles("C(C=O)N"));
Assert.AreEqual(4, glycine.Atoms.Count);
glycine.AddCTerminus(glycine.Atoms[1]);
AminoAcidManipulator.AddAcidicOxygen(glycine);
Assert.AreEqual(5, glycine.Atoms.Count);
}
