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QCML

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3papers using it

2025first seen

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Papers using QCML (3)

MACE4IRmol: An uncertainty-aware foundation model for molecular infrared spectroscopy2025 · 2 cites

How Accurate Are DFT Forces? Unexpectedly Large Uncertainties in Molecular Datasets2025 · 1 cites

How simple can you go? An off-the-shelf transformer approach to molecular dynamics2025 · 1 cites

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