Fragmenter cleaves single bonds to generate molecular fragments. The cleavage rules correspond to chemical reactions in order to enhance synthetic accessibility. The cleavage points on the fragments are labeled with the cleavage rules.

Input Ports

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

Output Ports

  1. Type: Data
    Output table that contains fragments structure in Marvin format.


This node is part of the extension

ChemAxon/Infocom JChem Extensions Feature


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