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Synergy of Single-Atom Ni-1 and Ru-1 Sites on CeO2 for Dry Reforming of CH4 期刊论文
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 2019, 卷号: 141, 期号: 18, 页码: 7283-7293
Authors:  Tang, Yu;  Wei, Yuechang;  Wang, Ziyun;  Zhang, Shiran;  Li, Yuting;  Nguyen, Luan;  Li, Yixiao;  Zhou, Yan;  Shen, Wenjie;  Tao, Franklin Feng;  Hu, Peijun
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Dynamical Transformation of Two-Dimensional Perovskites with Alternating Cations in the Interlayer Space for High-Performance Photovoltaics 期刊论文
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 2019, 卷号: 141, 期号: 6, 页码: 2684-2694
Authors:  Zhang, Yalan;  Wang, Peijun;  Tang, Ming-Chun;  Barrit, Dounya;  Ke, Weijun;  Liu, Junxue;  Luo, Tao;  Liu, Yucheng;  Niu, Tianqi;  Smilgies, Detlef-M;  Yang, Zhou;  Liu, Zhike;  Jin, Shengye;  Kanatzidis, Mercouri G.;  Arnassian, Aram;  Liu, Shengzhong Frank;  Zhao, Kui
Favorite  |  View/Download:4/0  |  Submit date:2019/06/20
Theoretical Studies on the Folding Mechanisms for Different DNA G-quadruplexes 期刊论文
ADVANCE IN STRUCTURAL BIOINFORMATICS, 2015, 卷号: 827, 页码: 123-141
Authors:  Wu, Xue;  Xu, Peijun;  Wang, Jinguang;  Xu, Yong;  Fu, Ting;  Zhao, Meixia;  Zhang, Depeng;  Liu, Jiahui;  Shen, Hujun;  Xiu, Zhilong;  Li, Guohui;  Wei, D;  Xu, Q;  Zhao, T;  Dai, H
Favorite  |  View/Download:58/0  |  Submit date:2015/11/17
G-quadruplex  Go-model  Fold  
Binding Modes and Interaction Mechanism Between Different Base Pairs and Methylene Blue Trihydrate: A Quantum Mechanics Study 期刊论文
ADVANCE IN STRUCTURAL BIOINFORMATICS, 2015, 卷号: 827, 页码: 187-203
Authors:  Xu, Peijun;  Wang, Jinguang;  Xu, Yong;  Chu, Huiying;  Shen, Hujun;  Zhang, Depeng;  Zhao, Meixia;  Liu, Jiahui;  Li, Guohui;  Wei, D;  Xu, Q;  Zhao, T;  Dai, H
Favorite  |  View/Download:69/0  |  Submit date:2015/11/17
Dna Base Pairs  Intercalators Methylene Blue Trihydrate  Quantum Mechanic Methods  Charge Density  
Folding Mechanisms of Trefoil Knot Proteins Studied by Molecular Dynamics Simulations and Go-model 期刊论文
ADVANCE IN STRUCTURAL BIOINFORMATICS, 2015, 卷号: 827, 页码: 93-110
Authors:  Wu, Xue;  Xu, Peijun;  Wang, Jinguang;  Xu, Yong;  Fu, Ting;  Zhang, Depeng;  Zhao, Meixia;  Liu, Jiahui;  Shen, Hujun;  Xiu, Zhilong;  Li, Guohui;  Wei, D;  Xu, Q;  Zhao, T;  Dai, H
Favorite  |  View/Download:85/0  |  Submit date:2015/11/17
Trefoil  Knot  High-temperature Unfolding  Go-model  Fold  
Advancement of Polarizable Force Field and Its Use for Molecular Modeling and Design 期刊论文
ADVANCE IN STRUCTURAL BIOINFORMATICS, 2015, 卷号: 827, 页码: 19-32
Authors:  Xu, Peijun;  Wang, Jinguang;  Xu, Yong;  Chu, Huiying;  Liu, Jiahui;  Zhao, Meixia;  Zhang, Depeng;  Mao, Yingchen;  Li, Beibei;  Ding, Yang;  Li, Guohui;  Wei, D;  Xu, Q;  Zhao, T;  Dai, H
Favorite  |  View/Download:72/0  |  Submit date:2015/11/17
Polarizable Force Field  Amoeba  Fluctuating Charge Model  Induced Point Dipole Model  Molecular Modeling  
基于粗粒化模型对有机溶剂的分子动力学模拟 期刊论文
物理化学学报, 2011, 卷号: X, 期号: 待补充, 页码: 001
Authors:  许佩军;  唐媛媛;  张静;  张知博;  王昆;  邵颖;  沈虎峻;  毛英臣
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