Data Analytics and Machine Learning Group

Popular repositories Loading

1. gemnet_pytorch gemnet_pytorch Public

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

   Python 222 38

2. seml seml Public

   SEML: Slurm Experiment Management Library

   Python 194 36

3. pprgo_pytorch pprgo_pytorch Public

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

   Python 128 17

4. pprgo_tensorflow pprgo_tensorflow Public

   PPRGo model in TensorFlow 1, as proposed in "Scaling Graph Neural Networks with Approximate PageRank" (KDD 2020)

   Python 36 7

5. synthetic_coordinates synthetic_coordinates Public

   Synthetic coordinates for GNNs, as proposed in "Directional Message Passing on Molecular Graphs via Synthetic Coordinates" (NeurIPS 2021)

   Python 32 6

6. dbu-robustness dbu-robustness Public

   Evaluating Robustness of Predictive Uncertainty Estimation: Are Dirichlet-based Models Reliable ? (ICML 2021)

   Python 28