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R-group_​decomposition_​protocol

Insert SMILESstringNode 3generate scaffoldprune side chainsprune side chainsNode 51Table Creator Molecule Type Cast RDKit FindMurcko Scaffolds RDKit R-GroupDecomposition R-Group Decomposer Atom Replacer Insert SMILESstringNode 3generate scaffoldprune side chainsprune side chainsNode 51Table Creator Molecule Type Cast RDKit FindMurcko Scaffolds RDKit R-GroupDecomposition R-Group Decomposer Atom Replacer

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Download

To use this workflow in KNIME, download it from the below URL and open it in KNIME:

Download Workflow
Created by: c.cerchia
Created at: 2021-05-23
On NodePit since: 2022-02-06
Last update: 2024-11-17
Created with KNIME version: v4.3.2

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