The paper maps the tiered graph autoencoder and its variational variant onto PyTorch Geometric components, and proposes a data pipeline with standard chemical identifiers.
Semi-supervised Classification with Graph Convolutional Networks,
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Tiered Graph Autoencoders with PyTorch Geometric for Molecular Graphs
The paper maps the tiered graph autoencoder and its variational variant onto PyTorch Geometric components, and proposes a data pipeline with standard chemical identifiers.