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1. AIRS AIRS Public

   Artificial Intelligence Research for Science (AIRS)

   Jupyter Notebook 689 80

2. DIG DIG Public

   A library for graph deep learning research

   Python 2k 290

3. GraphBP GraphBP Public

   Official implementation of "Generating 3D Molecules for Target Protein Binding" [ICML2022 Long Presentation]

   Python 109 24

4. MoleculeX MoleculeX Public

   Python 170 25

5. GOOD GOOD Public

   GOOD: A Graph Out-of-Distribution Benchmark [NeurIPS 2022 Datasets and Benchmarks]

   Python 202 22

6. lgcn lgcn Public

   Python 137 65