Associative Learning
Sampling Methods: Overview
Sampling Methods: Sample Types
Multi-input and Multi-variable systems
Sampling Plans
Generalization, Discrimination, and Extinction
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Haohao Fu1,2, Hengwei Bian1,2, Xueguang Shao1,2
1Research Center for Analytical Sciences, Frontiers Science Center for New Organic Matter, College of Chemistry, Nankai University, Tianjin Key Laboratory of Biosensing and Molecular Recognition, State Key Laboratory of Medicinal Chemical Biology, Tianjin 300071, China.
增强采样模拟使用集体变量 (CV) 来研究复杂的过程. 机器学习提供了一种强大的方法来确定最佳的CV,以提高模拟效率和分子动态的准确性.
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