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Top 2 graph-transformer open source projects

Source code for GNN-LSPE (Graph Neural Networks with Learnable Structural and Positional Representations), ICLR 2022

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python Jupyter Notebook shell graphs transformers attention representation-learning molecules message-passing lspe geometric-deep-learning graph-neural-networks graph-representation-learning gnn graph-deep-learning positional-encoding graph-transformer transformer-networks gnn-lspe

Deep learning toolkit for Drug Design with Pareto-based Multi-Objective optimization in Polypharmacology

✭ 128

python reinforcement-learning deep-learning cheminformatics multi-objective-optimization graph-transformer

1-2 of 2 graph-transformer projects