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Ultra-fast interpretable machine-learning potentials - npj Computational Materials

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Ultra-fast interpretable machine-learning potentials - npj Computational Materials

All-atom dynamics simulations are an indispensable quantitative tool in physics, chemistry, and materials science, but large systems and long simulation times remain challenging due to the trade-off between computational efficiency and predictive accuracy.

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Ultra-fast interpretable machine-learning potentials - npj Computational Materials

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Ultra-fast interpretable machine-learning potentials - npj Computational Materials

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