Josef Dean

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

A. Fitzgibbon, Ladislav Rampášek, Dominic Masters, 2023, ArXiv.

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

Ladislav Rampášek, Dominic Masters, D. Beker, 2022, ArXiv.

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

A. Fitzgibbon, Ladislav Rampášek, Dominic Masters, 2023, ArXiv.

Towards Foundational Models for Molecular Learning on Large-Scale Multi-Task Datasets

Jama Hussein Mohamud, M. Ravanelli, Reihaneh Rabbany, 2023, ICLR.