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"On the design space between molecular mechanics and machine learning force ..."
Yuanqing Wang et al. (2024)
- Yuanqing Wang, Kenichiro Takaba, Michael S. Chen, Marcus Wieder, Yuzhi Xu, Tong Zhu, John Z. H. Zhang, Arnav Nagle, Kuang Yu, Xinyan Wang, Daniel J. Cole, Joshua A. Rackers, Kyunghyun Cho, Joe G. Greener, Peter K. Eastman, Stefano Martiniani, Mark E. Tuckerman:
On the design space between molecular mechanics and machine learning force fields. CoRR abs/2409.01931 (2024)
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