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1. ppnp ppnp Public

   PPNP & APPNP models from "Predict then Propagate: Graph Neural Networks meet Personalized PageRank" (ICLR 2019)

   Jupyter Notebook 322 55

2. gdc gdc Public

   Graph Diffusion Convolution, as proposed in "Diffusion Improves Graph Learning" (NeurIPS 2019)

   Python 273 42

3. dimenet dimenet Public

   DimeNet and DimeNet++ models, as proposed in "Directional Message Passing for Molecular Graphs" (ICLR 2020) and "Fast and Uncertainty-Aware Directional Message Passing for Non-Equilibrium Molecules…

   Python 350 67

4. TUM-DAML/gemnet_pytorch TUM-DAML/gemnet_pytorch Public

   GemNet model in PyTorch, as proposed in "GemNet: Universal Directional Graph Neural Networks for Molecules" (NeurIPS 2021)

   Python 215 35

5. TUM-DAML/pprgo_pytorch TUM-DAML/pprgo_pytorch Public

   PPRGo model in PyTorch, as proposed in "Scaling Graph Neural Networks with Approximate PageRank" (KDD 2020)

   Python 127 17

6. TUM-DAML/seml TUM-DAML/seml Public

   SEML: Slurm Experiment Management Library

   Python 186 35