MCS Scaffold Finder

Other

This node finds the maximum common scaffold (MCS) of an arbitrary amount of the input molecules. In case of multiple MCS, they are all written to the output table

Supported types:

  • Molecule: String, SDF, Smiles, CML, Mol, InChI

The node is based on the Indigo cheminformatics toolkit.

Input Ports

  1. Type: Data Table containing molecules

Output Ports

  1. Type: Data Query molecules that are the found maximum common scaffolds.

Find here

Community Nodes > Indigo 2 > Molecule Nodes

Make sure to have this extension installed:

Indigo KNIME integration

Update site for KNIME Analytics Platform 3.7:
Stable Community Contributions

How to add and enable update sites

How to install extensions