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Rearrangements of Water Molecules in Parallel Cascade Selection Molecular Dynamics Enhance Structural Explorations of Proteins
Bulletin of the Chemical Society of Japan ( IF 4 ) Pub Date : 2021-01-15 , DOI: 10.1246/bcsj.20200174
Rikuri Morita 1 , Yasuteru Shigeta 1 , Ryuhei Harada 1
Affiliation  

Biological events of protein are too infrequent to observe with molecular dynamics (MD) simulations, though they are strongly related to the biological functions. To detect such rare events, severa...

中文翻译:

平行级联选择中水分子的重排分子动力学增强了蛋白质的结构探索

蛋白质的生物事件太罕见,无法用分子动力学 (MD) 模拟观察,尽管它们与生物功能密切相关。为了检测这种罕见的事件,几个...
更新日期:2021-01-15
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