Generate molecules with REINVENT and make interactive plot #RDKit #Knime #REINVENT

I introduced to use user defined condaenv in Knime. It’s really useful I think. Make chemoinformatics workflow by Kinme with user defined conda envrionment #Knime #Chemoinforamtics #memo And as you know, REINVENT is the one of famous compound generation tool for drug discovery. Its community provides lots of example codes as jupyternotebook. After building someContinue reading “Generate molecules with REINVENT and make interactive plot #RDKit #Knime #REINVENT”

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