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Determination of thermal intermediate state ensemble of box 5 with restrained molecular dynamics simulations 期刊论文
computational and theoretical chemistry, 2011, 卷号: 978
Zhao, LL; Liu, ZJ; Cao, ZX; Liu, HY; Wang, JH
收藏  |  浏览/下载:20/0  |  提交时间:2012/07/16
Structure change of beta-hairpin induced by turn optimization: An enhanced sampling molecular dynamics simulation study 期刊论文
JOURNAL OF CHEMICAL PHYSICS, 2011, 卷号: 135, 期号: 23
作者:  Shao, Qiang;  Yang, Lijiang;  Gao, Yi Qin
收藏  |  浏览/下载:10/0  |  提交时间:2019/04/09
An ab initio quasi-diabatic potential energy matrix for OH((2)Sigma) + H-2 期刊论文
journal of chemical physics, 2011, 卷号: 135, 期号: 23
作者:  Collins, Michael A.;  Godsi, Oded;  Liu, Shu;  Zhang, Dong H.
收藏  |  浏览/下载:16/0  |  提交时间:2015/11/12
First-principles investigation on the structural stability of methane and ethane clathrate hydrates 期刊论文
COMPUTATIONAL AND THEORETICAL CHEMISTRY, 2011, 卷号: 977, 期号: 1-3, 页码: 209-212
作者:  Xua, Luzhi;  Wang, Xu;  Liu, Liuxia;  Yang, Minghui
收藏  |  浏览/下载:14/0  |  提交时间:2015/06/25
Direct imaging of the Fermi resonance interaction in para-difluorobenzene: A special insight into energy redistributions in the S-1 low-energy regime 期刊论文
PHYSICAL REVIEW A, 2011, 卷号: 84, 期号: 6
作者:  Long, Jinyou;  Qin, Chaochao;  Liu, Yuzhu;  Zhang, Song;  Zhang, Bing
收藏  |  浏览/下载:26/0  |  提交时间:2015/11/30
A specific protein disorder catalyzer of HIV-1 Nef 期刊论文
Bioorganic & Medicinal Chemistry, 2011, 卷号: 19, 期号: 24, 页码: 7401-7406
A. Lugari; S. Breuer; T. Coursindel; S. Opi; A. Restouin; X. L. Shi; A. Nazabal; B. E. Torbett; J. Martinez; Y. Collette; I. Parrot; S. T. Arold; X. Morelli
收藏  |  浏览/下载:490/0  |  提交时间:2012/06/06
Large "near junction" thermal resistance reduction in electronics by interface nanoengineering 期刊论文
INTERNATIONAL JOURNAL OF HEAT AND MASS TRANSFER, 2011, 卷号: 54, 期号: 25-26, 页码: 5183-5191
作者:  Hu, Ming;  Zhang, Xiaoliang;  Poulikakos, Dimos;  Grigoropoulos, Costas P.
收藏  |  浏览/下载:30/0  |  提交时间:2015/12/18
Assessment of Some Density Functional Theory Methods and Force Field Models in Describing Various Interaction Modes of Benzene Dimer 期刊论文
http://dx.doi.org/10.1088/1674-0068/24/06/635-639, 2011
Zhou, Yu-wei; Zhang, Igor Ying; Wu, Jian-ming; Wu, An-an; Xu, Xin; 徐昕
收藏  |  浏览/下载:3/0  |  提交时间:2015/07/22
Influence of Flexible Oligo(tetrafluoroethene) Segment on the Sorption and Diffusion of Carbon Dioxide in Poly(amide-imide) Membranes 期刊论文
2011
Chen, Yu; Huang, Shu Ping; Liu, Qing Lin; 刘庆林; Broadwell, Ian; Zhu, Al Mei; 朱爱梅
收藏  |  浏览/下载:3/0  |  提交时间:2012/03/07
Separation of hydrogen and nitrogen gases with porous graphene membrane 期刊论文
Journal of physical chemistry c, 2011, 卷号: 115, 期号: 47, 页码: 23261-23266
作者:  Du, Huailiang;  Li, Jingyuan;  Zhang, Jing;  Su, Gang;  Li, Xiaoyi
收藏  |  浏览/下载:27/0  |  提交时间:2019/04/23


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