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1. TGSA TGSA Public

   PyTorch implementation of "TGSA: Protein-Protein Association-Based Twin Graph Neural Networks for Drug Response Prediction with Similarity Augmentation"

   Python 23 17

2. MolHF MolHF Public

   Official implementation of IJCAI'23 paper "MolHF: A Hierarchical Normalizing Flow for Molecular Graph Generation"

   14

3. HN-GFN HN-GFN Public

   Official implementation of NeurIPS'23 paper "Sample-efficient Multi-objective Molecular Optimization with GFlowNets"

   Python 15 2

4. Bridge-IF Bridge-IF Public

   Official implementation of NeurIPS'24 paper "Bridge-IF: Learning Inverse Protein Folding with Markov Bridges"

   7