Icon

Workflow_​Functional Groups

ConvertsSMILES-stringto SMILESCounts functionalgroups in moleculesConvertsSMILES-stringto SMILESGenerates molecule structues from SMILES (Functional groups)Generates moleculestructures from SMILES(from Test set)Node 143Node 144Molecule Type Cast RDKit SubstructureCounter Molecule Type Cast RDKit From Molecule RDKit From Molecule Table Creator Table Creator ConvertsSMILES-stringto SMILESCounts functionalgroups in moleculesConvertsSMILES-stringto SMILESGenerates molecule structues from SMILES (Functional groups)Generates moleculestructures from SMILES(from Test set)Node 143Node 144Molecule Type Cast RDKit SubstructureCounter Molecule Type Cast RDKit From Molecule RDKit From Molecule Table Creator Table Creator

Nodes

Extensions

Links

Download

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

Download Workflow
Created by: BRUGGBR2
Created at: 2022-04-29
On NodePit since: 2022-04-29
Last update: 2024-12-24
Created with KNIME version: v4.3.4

Deploy, schedule, execute, and monitor your KNIME workflows locally, in the cloud or on-premises – with our brand new NodePit Runner.

Try NodePit Runner!