[Rdkit-discuss] Molecular weight function
Open-Source Cheminformatics and Machine Learning
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From: Navid Shervani-T. <ns...@gm...> - 2020-04-08 20:34:17
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Hello, I was wondering if the word "average" in the following function and description: rdkit.Chem.Descriptors.MolWt(**x*, ***y*) <https://www.rdkit.org/docs/source/rdkit.Chem.Descriptors.html#rdkit.Chem.Descriptors.MolWt> The average molecular weight of the molecule is referring to average over all possible molecule with different isotopes of the atoms in the molecule (including hydrogen). Thanks, Navid |