Accelerating Metadynamics-Based Free-Energy Calculations with Adaptive Machine Learning Potentials
出版年份 2021 全文链接
标题
Accelerating Metadynamics-Based Free-Energy Calculations with Adaptive Machine Learning Potentials
作者
关键词
-
出版物
Journal of Chemical Theory and Computation
Volume 17, Issue 7, Pages 4465-4476
出版商
American Chemical Society (ACS)
发表日期
2021-06-08
DOI
10.1021/acs.jctc.1c00261
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