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An Open Source implementation of Notebook LM with more flexibility and features

TypeScript 17,763 1,913 Updated Jan 10, 2026

Graphormer is a general-purpose deep learning backbone for molecular modeling.

Python 2,414 372 Updated Jun 7, 2024

Practical Cheminformatics Tutorials

Jupyter Notebook 1,159 207 Updated Dec 14, 2025

Auto3D generates low-energy conformers from SMILES/SDF

Python 185 39 Updated Jan 2, 2026