[Rdkit-devel] Canonical atom order
Open-Source Cheminformatics and Machine Learning
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From: Maciek W. <ma...@wo...> - 2015-01-29 16:27:21
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Hello RDKiters, I'd like somehow to get canonical atoms order for RDKit Mol in python. Is there a method/hack to get it? I've went though some code on github, but cant see any method to get those data in python... ---- Pozdrawiam, | Best regards, Maciek Wójcikowski ma...@wo... |