Ben Bowen

NADH looks like this ```python original_smiles = 'NC(=O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](N4C=NC5=C4N=CN=C5N)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1' original_mol = Chem.MolFromSmiles(original_smiles) tautomerized_mol = TautomerCanonicalizer().canonicalize(original_mol) Draw.MolsToGridImage([original_mol,tautomerized_mol], molsPerRow=1,subImgSize=(600,300), legends=['original','tautomer']) ``` 

You are correct, removing that rule stops that moiety from being modified. When you say, "more strict", you think specify an explicit number of bonds on the Phosphorous in the...

I just saw this in my email with the at-mention. I'm so sorry for 1 year of silence! but I'm excited that others are looking and working on this. The...