Make RGroup decompose table with old ver. RDKit #RDKit #Chemoinformatics

ObjectiveRecent version of RDKit has rdRGroupDecomposition module for R Group decomposition. You know, it is very useful module for SAR analysis. However this function is not implemented in old version of rdkit (i.e. rdkit for 32 bit windows). I would like to implement similar module for 32bit windows system. My approach with codeSo, I triedContinue reading “Make RGroup decompose table with old ver. RDKit #RDKit #Chemoinformatics”

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