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Rxn/RD Reader

ChemistryI/O
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This node reads one or more Rxn/RD files and creates several columns with each reaction in a new row. You can select which parts of the reaction should be extracted into columns in the output table.
RD file support is limited to embedded Rxn files ($RFMT entries) and not thoroughly tested because of the lack of publicly available RD files. Moreover, it only extracts the Rxn-parts from the RDfiles.

Node details

Output ports
  1. Type: Table
    Read reactions
    Table with the read reactions
  2. Type: Table
    Broken reactions
    Table with illegal Rxn records

Extension

The Rxn/RD Reader node is part of this extension:

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Related workflows & nodes

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