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Component Combiner

Community Nodes Indigo 2 Molecule Nodes
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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.

Node details

Input ports
  1. Type: Table
    Input molecules
    Table containing molecules or query molecules
Output ports
  1. Type: Table
    Joined components
    The same as input, plus the column with the combined components
  2. Type: Table
    Invalid data
    The same as input, contains rows with invalid data

Extension

The Component Combiner node is part of this extension:

Related workflows & nodes