Learning Pair Potentials using Differentiable Simulations

• Wang, Wujie
• Wu, Zhenghao
• Dietschreit, Johannes Carl Bertold
• Rafael Gómez-Bombarelli

Learning Pair Potentials using Differentiable Simulations

The Journal of Chemical Physics

,

vol.

158

,

pp.

044113

,

2023

.

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DOI