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Sigmoid Accelerated Molecular Dynamics: An Efficient Enhanc..:

Zhao, Yihao ; Zhang, Jintu ; Zhang, Haotian...
The Journal of Physical Chemistry Letters.  14 (2023)  4 - p. 1103-1112 , 2023
Link: https://doi.org/10.1021/acs.jpclett.2c03688