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Experimental and Theoretical Study of Deprotonation of DNA Adenine Cation Radical 期刊论文
CHINESE JOURNAL OF CHEMICAL PHYSICS, 2017, 卷号: 30, 期号: 6, 页码: 664-670
作者:  Jie, Jia-long;  Wang, Chen;  Zhao, Hong-mei;  Song, Di;  Su, Hong-mei
收藏  |  浏览/下载:146/0  |  提交时间:2019/04/09
Effect of structural phase transformations under pressure on electronic and optical properties of CuInS2 期刊论文
Current Applied Physics, 2017, 卷号: 17, 期号: 11, 页码: 1564-1569
作者:  Gao, Bo;  Xue, Hong-Tao;  Tang, Fu-Ling;  Cheng, Yu-Wen
收藏  |  浏览/下载:15/0  |  提交时间:2022/02/17
Effect of structural phase transformations under pressure on electronic and optical properties of CuInS2 期刊论文
CURRENT APPLIED PHYSICS, 2017, 卷号: 17, 期号: 11, 页码: 1564-1569
作者:  Gao, Bo;  Xue, Hong-Tao;  Tang, Fu-Ling;  Cheng, Yu-Wen
收藏  |  浏览/下载:0/0  |  提交时间:2019/11/15
Virtual screening of B-Raf kinase inhibitors: A combination of pharmacophore modelling, molecular docking, 3D-QSAR model and binding free energy calculation studies 期刊论文
COMPUTATIONAL BIOLOGY AND CHEMISTRY, 2017, 卷号: 70, 页码: 186-190
作者:  Zhang, Wen;  Qiu, Kai-Xiong;  Yu, Fang;  Xie, Xiao-Guang;  Zhang, Shu-Qun
收藏  |  浏览/下载:24/0  |  提交时间:2017/12/11
Effective Conformational Sampling in Explicit Solvent with Gaussian Biased Accelerated Molecular Dynamics 期刊论文
JOURNAL OF CHEMICAL THEORY AND COMPUTATION, 2017, 卷号: 13, 期号: 9, 页码: 4240-4252
作者:  Shao, Qiang;  Zhu, Weiliang
收藏  |  浏览/下载:6/0  |  提交时间:2019/01/08
A molecular dynamics simulation study of irradiation induced defects in gold nanowire 期刊论文
NUCLEAR INSTRUMENTS & METHODS IN PHYSICS RESEARCH SECTION B-BEAM INTERACTIONS WITH MATERIALS AND ATOMS, 2017, 卷号: 405, 页码: 22-30
作者:  Liu, Wenqiang;  Chen, Piheng;  Qiu, Ruizhi;  Khan, Maaz;  Liu, Jie
收藏  |  浏览/下载:47/0  |  提交时间:2018/05/31
Mechanical, electronic and thermodynamic properties of hexagonal and orthorhombic U2Mo: A first-principle calculation 期刊论文
PROGRESS IN NUCLEAR ENERGY, 2017, 卷号: 99, 期号: 无, 页码: 110-118
作者:  Chen, Ke;  Tian, Xiaofeng;  Yu, You;  You, Zhenjiang;  Ge, Liangquan
收藏  |  浏览/下载:20/0  |  提交时间:2018/06/04
Mechanisms of methane generation from anthracite at low temperatures: Insights from quantum chemistry calculations 期刊论文
INTERNATIONAL JOURNAL OF HYDROGEN ENERGY, 2017, 卷号: 42, 期号: 30, 页码: 18922-18929
作者:  Wang, Jin;  Han, Yuzhen;  Chen, Bozhen;  Guo, Guangjun;  Hou, Quanlin
收藏  |  浏览/下载:32/0  |  提交时间:2017/11/24
光学球罩气动热及其响应分析 学位论文
博士, 沈阳: 中国科学院沈阳自动化研究所, 2017
作者:  张代军
收藏  |  浏览/下载:57/0  |  提交时间:2017/06/29
Sudden Penumbral Reappearance and Umbral Motion Induced by an M7.9 Solar Flare 期刊论文
ASTROPHYSICAL JOURNAL LETTERS, 2017, 卷号: 840, 期号: 2
作者:  Xu Z(徐喆);  Jiang YC(姜云春);  Yang JY(杨家艳);  Hong JC(洪俊超);  Li HD(李海东)
收藏  |  浏览/下载:11/0  |  提交时间:2017/07/10


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