Answer by Vandan Revanur for How to do SMARTS reaction substructure mapping...
I changed the c_h_template to also use smiles and the substructMatch returns True.I am using rdkit version number: 2022.9.4Here is the full reproducible code.from rdkit.Chem import AllChemfrom...
View ArticleHow to do SMARTS reaction substructure mapping with RDKit
I have been trying to use the RDKit's reaction substructure matching for some time. I want to match all reactions where a C-H bond is being broken to form a new C-C bond.This is my code:from rdkit.Chem...
View Article
More Pages to Explore .....