/tools/practical_cheminformatics_tutorials

practical_cheminformatics_tutorials

PatWalters/practical_cheminformatics_tutorials

1,176 stars207 forksJupyter NotebookAdded February 5, 2026
summary

This repository provides a collection of Jupyter notebooks designed to teach practical cheminformatics using open-source software. It covers various topics including molecular property prediction, generative molecular design, and machine learning models applicable to cheminformatics workflows.

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Practical Cheminformatics Tutorials

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