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1. Genentech/CLADD Genentech/CLADD Public

   The official source code for "RAG-Enhanced Collaborative LLM Agents for Drug Discovery"

   Python 17 3

2. 3DMRL 3DMRL Public

   The official source code for "3D Interaction Geometric Pre-training for Molecular Relational Learning"

   Python 23

3. CMRL CMRL Public

   The official source code for "Shift-Robust Molecular Relational Learning with Causal Substructure"

   Python 25 1

4. CGIB CGIB Public

   The official source code for "Conditional Graph Information Bottleneck for Molecular Relational Learning".

   Python 44 4

5. AFGRL AFGRL Public

   The official source code for "Augmentation-Free Self-Supervised Learning on Graphs"

   Python 79 14

6. BGRL_Pytorch BGRL_Pytorch Public

   Pytorch implementation of "Large-Scale Representation Learning on Graphs via Bootstrapping"

   Python 83 8