Transfer learning using attentions across atomic systems with graph neural networks (TAAG)

作者： Adeesh Kolluru , Nima Shoghi , Muhammed Shuaibi , Siddharth Goyal , Abhishek Das

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摘要: Recent advances in Graph Neural Networks (GNNs) have transformed the space of molecular and catalyst discovery. Despite the fact that the underlying physics across these …

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Transfer learning using attentions across atomic systems with graph neural networks (TAAG)

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Transfer learning using attentions across atomic systems with graph neural networks (TAAG)

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