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CDK to Molecule

Community Nodes CDK I/O
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Converts the CDK molecules in one of the input table's columns into various string representations (SDF, Mol2, Smiles, CML).

This node uses CDK classes to parse and display structures.

Node details

Input ports
  1. Type: Table
    CDK molecules
    Table containing CDK molecules
Output ports
  1. Type: Table
    Converted string representations
    Table with the molecules' converted string representations

Extension

The CDK to Molecule node is part of this extension:

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