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1. graph-tutorial.pytorch graph-tutorial.pytorch Public

   Forked from bmsookim/graph-tutorial.pytorch

   Pytorch Tutorial for Non-Euclidean Graph Representations

   Python

2. ochem_predict_nn ochem_predict_nn Public

   Forked from connorcoley/ochem_predict_nn

   Python

3. SGC SGC Public

   Forked from Tiiiger/SGC

   official implementation for the paper "Simplifying Graph Convolutional Networks"

   Python

4. rdkit/rdkit rdkit/rdkit Public

   The official sources for the RDKit library

   HTML 2.7k 879

5. bigchem/retrosynthesis bigchem/retrosynthesis Public

   Applying deep neural networks for retrosynthesis tasks

   TeX 35 11

6. aimat-lab/gcnn_keras aimat-lab/gcnn_keras Public

   Graph convolutions in Keras with TensorFlow, PyTorch or Jax.

   Jupyter Notebook 110 30