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NodeNode / Manipulator

Topology Analysis

ChemAxon / Infocom JChem Calculator Plugins Geometry Streamable
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The Topology Analysis Plugin calculates different topological descriptors for a molecule.

Node details

Input ports
  1. Type: Table
    Data Input
    Input table that contains structure in Structure(Mrv, Sdf, Smiles, etc.) format.
Output ports
  1. Type: Table
    Data Output
    Output table that contains topology.

Extension

The Topology Analysis node is part of this extension:

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Related workflows & nodes

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    Chemical_data_for_machine_learning
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    nizamibilal1064 > Public > ChemAxon's Chemical Data cleaning > Chemical_data_ML_ChemAxon
    nizamibilal1064
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