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Metric-Based Assessment Method for MS-T Formalism with Small Subsets of Torsional Conformers 期刊论文
JOURNAL OF PHYSICAL CHEMISTRY A, 44, 2022, 卷号: 126, 页码: 8305-8314
作者:  Chi, Yicheng;  Meng, Qinghui;  He, Chengming;  Zhang, Peng
收藏  |  浏览/下载:8/0  |  提交时间:2023/02/13
Stochastic Lag Time Parameterization for Markov State Models of Protein Dynamics 期刊论文
JOURNAL OF PHYSICAL CHEMISTRY B, 2022, 页码: 11
作者:  Gong, Shiqi;  He, Xinheng;  Meng, Qi;  Ma, Zhiming;  Shao, Bin
收藏  |  浏览/下载:18/0  |  提交时间:2023/02/07
Dependence of the rate-limiting steps in the dark-to-light transition of photosystem II on the lipidic environment of the reaction center 期刊论文
PHOTOSYNTHETICA, 2022, 卷号: 60, 期号: 1, 页码: 147-156
作者:  Magyar, M.;  Akhtar, P.;  Sipka, G.;  Han, W.;  LI, X.
收藏  |  浏览/下载:0/0  |  提交时间:2024/03/07
Light-induced reversible reorganizations in closed Type II reaction centre complexes: physiological roles and physical mechanisms 期刊论文
OPEN BIOLOGY, 2022, 卷号: 12, 期号: 12
作者:  Sipka, G.;  Nagy, L.;  Magyar, M.;  Akhtar, P.;  Shen, J. -r.
收藏  |  浏览/下载:0/0  |  提交时间:2024/03/07
Conformational polymorphs of isotretinoin and their impact on physicochemical and biological properties 期刊论文
INTERNATIONAL JOURNAL OF PHARMACEUTICS, 2021, 卷号: 610, 页码: 10
作者:  Cheng, Yinxiang;  Rong, Xiaoyi;  Xia, Mengyuan;  Zhang, Zaiyong;  Wang, Jian-Rong
收藏  |  浏览/下载:73/0  |  提交时间:2022/01/04
Exploring the Regulatory Function of the N-terminal Domain of SARS-CoV-2 Spike Protein through Molecular Dynamics Simulation 期刊论文
ADVANCED THEORY AND SIMULATIONS, 2021, 页码: 13
作者:  Li, Yao;  Wang, Tong;  Zhang, Juanrong;  Shao, Bin;  Gong, Haipeng
收藏  |  浏览/下载:50/0  |  提交时间:2021/11/04
Activation pathway of a G protein-coupled receptor uncovers conformational intermediates as targets for allosteric drug design 期刊论文
NATURE COMMUNICATIONS, 2021, 卷号: 12, 期号: 1, 页码: 15
作者:  Lu, Shaoyong;  He, Xinheng;  Yang, Zhao;  Chai, Zongtao;  Zhou, Shuhua
收藏  |  浏览/下载:35/0  |  提交时间:2021/11/04
Molecular Dynamics Simulations Reveal the Modulated Mechanism of STING Conformation 期刊论文
INTERDISCIPLINARY SCIENCES-COMPUTATIONAL LIFE SCIENCES, 2021, 页码: 15
作者:  Chen, Li;  Zhao, Shuang;  Zhu, Yanyan;  Liu, Yongsheng;  Li, Huiyu
收藏  |  浏览/下载:26/0  |  提交时间:2021/08/17
Reexamining the role of intercrystalline links in the II-I phase transition of Poly(1-butene) 期刊论文
POLYMER, 2021, 卷号: 224
作者:  Li, Xiangyang;  Chen, Pujing;  Xu, Min;  Ding, Jianjun;  Zheng, Kang
收藏  |  浏览/下载:71/0  |  提交时间:2021/06/15
Molecular conformation modulating luminescence switching between delayed fluorescence and room-temperature phosphorescence 期刊论文
Journal of Materials Chemistry C, 2021, 卷号: 9, 期号: 48, 页码: 17511-17517
作者:  Y. Wen;  S. Xiao;  H. Liu;  X. Tian;  J. De
收藏  |  浏览/下载:9/0  |  提交时间:2022/06/13


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