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82760 Fragment_​SMILES_​replace_​single_​fragment

get length of structure SMILESNode 185Node 186Node 189Node 190Node 191Node 192Change Cl, Br back from one letter representationNode 204File containingAtoms and SMILESSMILESNode 290AtomsChange Cl, Br to one letter representationSMILESNode 295CannonicalNode 297Node 299Node 300Node 301Node 302String Manipulation Table Row ToVariable Loop Start Counting Loop Start Loop End (ColumnAppend) String Manipulation Empty Table Creator Transpose String Manipulation Loop End Excel Reader Column Filter Remove Empty Rows Column Filter String Manipulation Molecule Type Cast RDKit From Molecule Column Filter RDKit Canon SMILES SDF Writer Column Filter DuplicateRow Filter Table Rowto Variable get length of structure SMILESNode 185Node 186Node 189Node 190Node 191Node 192Change Cl, Br back from one letter representationNode 204File containingAtoms and SMILESSMILESNode 290AtomsChange Cl, Br to one letter representationSMILESNode 295CannonicalNode 297Node 299Node 300Node 301Node 302String Manipulation Table Row ToVariable Loop Start Counting Loop Start Loop End (ColumnAppend) String Manipulation Empty Table Creator Transpose String Manipulation Loop End Excel Reader Column Filter Remove Empty Rows Column Filter String Manipulation Molecule Type Cast RDKit From Molecule Column Filter RDKit Canon SMILES SDF Writer Column Filter DuplicateRow Filter Table Rowto Variable

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

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Created by: nsas
Created at: 2022-02-10
On NodePit since: 2026-05-29
Last update: 2026-05-29
Created with KNIME version: v4.7.8

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