Component Combiner

Manipulator

This node combines the input molecule components into joined molecules and writes the result molecules into the output table column. Defines the output column type automatically.

Supported types:

  • Molecule: String, SDF, Smiles, CML, Mol, InChI
  • Query molecule: String, SMARTS, Smiles, Mol, Sdf

The node is based on the Indigo cheminformatics toolkit.

Input Ports

  1. Type: Data Table containing molecules or query molecules

Output Ports

  1. Type: Data The same as input, plus the column with the combined components
  2. Type: Data The same as input, contains rows with invalid data

Find here

Community Nodes > Indigo 2 > Molecule Nodes

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