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LEARNING MATTER
Publications
Found 2 results
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is
Wu, Zhenghao
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2023
W. Wang
,
Wu, Z.
,
Dietschreit, J. Carl Berto
, and
Gómez-Bombarelli, R.
,
“
Learning Pair Potentials using Differentiable Simulations
”
,
The Journal of Chemical Physics
, vol. 158, p. 044113, 2023.
2022
X. Fu
,
Wu, Z.
,
Wang, W.
,
Xie, T.
,
Keten, S.
,
Gómez-Bombarelli, R.
, and
Jaakkola, T. S.
,
“
Forces are not Enough: Benchmark and Critical Evaluation for Machine Learning Force Fields with Molecular Simulations
”
,
arXiv:2210.07237
, 2022.