I’m working on a chemoinformatics project for my masters dissertation.
I am trying to break my Morgan fingerprints using BRICS however I notice there is no BRICS node on Knime. There is the molecule fragmenter node for RDKit but I need to break the fingerprint not the molecule.
Does anyone have any suggestions of how to do this? I am not too familiar with using python, but realise this might be a way to solve the issue?
Thanks in advance!