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"Data-Driven Parametrization of Molecular Mechanics Force Fields for ..."
Tianze Zheng et al. (2024)
- Tianze Zheng, Ailun Wang, Xu Han, Yu Xia, Xingyuan Xu, Jiawei Zhan, Yu Liu, Yang Chen, Zhi Wang, Xiaojie Wu, Sheng Gong, Wen Yan:
Data-Driven Parametrization of Molecular Mechanics Force Fields for Expansive Chemical Space Coverage. CoRR abs/2408.12817 (2024)
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