Scikit-Mol – Easy Embedding of RDKit into Scikit-Learn

Scikit-Mol originated during an RDKit hackathon and has gradually evolved into a tool that I looks extremely useful. Scikit-Mol is related to Scikit-learn and molecules, in a nutshell, it offers convenient Scikit-learn transformer objects that can transform molecules into features, such as fingerprints or descriptors.

There is a fabulous blog post here on Cheminformania describing it in detail.

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