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For Workflow: Reaction Enumeration Workflow
Reaction Enumeration Workflow (1)
This workflow performs a reaction enumeration. Therefore it loads a generic reaction rxn file and two educt lists. This SD-Files contains molecules for the enumeration. The products of the enumerated reaction are stored as Mol Files and a PDF will be created which contains the product molecules.
Created: 2008-11-21
Credits: Thomasku