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Molecular dynamics simulation study of the "stay or leave" problem for two magnesium ions in gene transcription 期刊论文
PROTEINS-STRUCTURE FUNCTION AND BIOINFORMATICS, 2017, 卷号: 85, 期号: 6, 页码: 1002-1007
Authors:  Wu, SG;  Wu, SG (reprint author), Sichuan Normal Univ, Coll Chem & Mat Sci, Chengdu 610066, Peoples R China.
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Molecular Dynamics Simulation  T7 Rna Polymerase  Magnesium Ion  Transcription Mechanism  Free Energy  
Anisotropic formation mechanism and nanomechanics for the self-assembly process of cross-beta peptides 期刊论文
CHINESE PHYSICS B, 2017, 卷号: 26, 期号: 12, 页码: 128701
Authors:  Deng, L;  Zhao, YR;  Zhou, P;  Xu, H;  Wang, YT
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Steered Molecular-dynamics  Atomic-force Microscopy  Particle Mesh Ewald  Amyloid Fibrils  Free-energy  Intermolecular Forces  Monte-carlo  Nanotubes  Systems  Simulations  
Dual Ionic and Organic Nature of Ionic Liquids 期刊论文
SCIENTIFIC REPORTS, 2016, 卷号: 6, 页码: 19644
Authors:  Shi, R;  Wang, YT;  Wang, YT (reprint author), Chinese Acad Sci, Inst Theoret Phys, State Key Lab Theoret Phys, 55 East Zhongguancun Rd,POB 2735, Beijing 100190, Peoples R China.
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Modulation of intra- and inter-sheet interactions in short peptide self-assembly by acetonitrile in aqueous solution 期刊论文
CHINESE PHYSICS B, 2016, 卷号: 25, 期号: 12, 页码: 128704
Authors:  Deng, L;  Zhao, YR;  Zhou, P;  Xu, H;  Wang, YT;  Xu, H (reprint author), China Univ Petr East China, Ctr Bioengn & Biotechnol, Qingdao 266580, Peoples R China.;  Wang, YT (reprint author), Chinese Acad Sci, Inst Theoret Phys, Key Lab Theoret Phys, Beijing 100190, Peoples R China.;  Wang, YT (reprint author), Univ Chinese Acad Sci, Sch Phys Sci, Beijing 100049, Peoples R China.
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Solvent Effect  Peptide Self-assembly  Molecular Dynamics Simulation  
Covalent intermolecular interaction of the nitric oxide dimer (NO)(2) 期刊论文
CHINESE PHYSICS B, 2015, 卷号: 24, 期号: 9, 页码: 93101
Authors:  Zhang, H;  Zheng, GL;  Lv, G;  Geng, YZ;  Ji, Q;  Ji, Q (reprint author), Hebei Univ Technol, Sch Sci, Tianjin 300401, Peoples R China.
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Nitric Oxide Dimer  Intermolecular Interaction  Natural Orbital  Covalent Bond  
Correlated lateral phase separations in stacks of lipid membranes 期刊论文
JOURNAL OF CHEMICAL PHYSICS, 2015, 卷号: 143, 期号: 24, 页码: 243124
Authors:  Hoshino, T;  Komura, S;  Andelman, D;  Hoshino, T (reprint author), Tokyo Metropolitan Univ, Grad Sch Sci & Engn, Dept Chem, Tokyo 1920397, Japan.
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On the Dynamics of Ionic Liquids: Comparisons between Electronically Polarizable and Nonpolarizable Models II 期刊论文
JOURNAL OF PHYSICAL CHEMISTRY B, 2010, 卷号: 114, 期号: 20, 页码: 6886-6904
Authors:  Yan, Tianying;  Wang, Yanting;  Knox, Craig;  Yan, TY , Nankai Univ, Inst New Energy Mat Chem, Tianjin 300071, Peoples R China
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Kerr-effect Spectroscopy  Molecular-force Field  1-butyl-3-methyl Imidazolium Hexafluorophosphate  Alkyl Chain-length  Transport-properties  Physicochemical Properties  Intermolecular Dynamics  Dielectric Response  Relaxation Processes  Computer-simulation