Ch 10 Graph Neural Networks

Example code

These examples show you how to create your own GNN in pytorch:
Chemistry example: https://colab.research.google.com/github/aswalker-lab/AIChemBiochem/blob/main/10_Graph_neural_networks/Chemistry_pytorch_GNNs.ipynb
Biochemistry example: https://colab.research.google.com/github/aswalker-lab/AIChemBiochem/blob/main/10_Graph_neural_networks/Biochemistry_pytorch_GNN.ipynb