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GPS++: Reviving the Art of Message Passing for Molecular Property Prediction


Feb 06, 2023
Dominic Masters, Josef Dean, Kerstin Klaser, Zhiyi Li, Sam Maddrell-Mander, Adam Sanders, Hatem Helal, Deniz Beker, Andrew Fitzgibbon, Shenyang Huang, Ladislav Rampášek, Dominique Beaini

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* arXiv admin note: text overlap with arXiv:2212.02229 

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GPS++: An Optimised Hybrid MPNN/Transformer for Molecular Property Prediction


Dec 06, 2022
Dominic Masters, Josef Dean, Kerstin Klaser, Zhiyi Li, Sam Maddrell-Mander, Adam Sanders, Hatem Helal, Deniz Beker, Ladislav Rampášek, Dominique Beaini

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