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1. spoc spoc Public

   An integrated Python package for molecular descriptor generation, data processing, model training, and hyper-parameter optimization.

   Python 8 2

2. ai4chem-fast-track-tutorial ai4chem-fast-track-tutorial Public

   4-8h fast-track AI4Chem tutorial with notebooks on SMILES, fingerprints, property prediction, reliability, and reaction optimization.

   Jupyter Notebook 3 1