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Kerstin Klaser

Generating QM1B with PySCF$_{\text{IPU}}$

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Nov 02, 2023
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Towards Foundational Models for Molecular Learning on Large-Scale Multi-Task Datasets

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Oct 18, 2023
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GPS++: Reviving the Art of Message Passing for Molecular Property Prediction

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Feb 06, 2023
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GPS++: An Optimised Hybrid MPNN/Transformer for Molecular Property Prediction

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Dec 06, 2022
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Acquisition-invariant brain MRI segmentation with informative uncertainties

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Nov 07, 2021
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The role of MRI physics in brain segmentation CNNs: achieving acquisition invariance and instructive uncertainties

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Nov 04, 2021
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