2020_11_05_RDKitPython_Webinar

This directory contains 2 workflows.

Clustering_and_RGD

This exercise shows how to perform hierarchical clustering based on molecule fingerprints and create an interactive view to pick interesting […]

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2020_​11_​05_​RDKitPython_​Webinar

Clustering_​and_​RGD

rdkit_​python_​basics

2020_11_05_RDKitPython_Webinar

Clustering_and_RGD

rdkit_python_basics