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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  
Molecular Origin of the Self-Assembled Morphological Difference Caused by Varying the Order of Charged Residues in Short Peptides 期刊论文
JOURNAL OF PHYSICAL CHEMISTRY B, 2014, 卷号: 118, 期号: 43, 页码: 12501-12510
Authors:  Deng, L;  Zhou, P;  Zhao, YR;  Wang, YT;  Xu, H;  Wang, YT (reprint author), Chinese Acad Sci, State Key Lab Theoret Phys, Inst Theoret Phys, 55 East Zhongguancun Rd,POB 2735, Beijing 100190, Peoples R China.
Favorite  |  View/Download:56/0  |  Submit date:2015/06/03
Particle Mesh Ewald  Amyloid Fibril  Alzheimers-disease  Dynamics Method  Biomolecules  Simulations  Systems  Conformations  Distributions  Transitions  
Conformational Dynamics of Dry Lamellar Crystals of Sugar Based Lipids: An Atomistic Simulation Study 期刊论文
PLOS ONE, 2014, 卷号: 9, 期号: 6, 页码: e101110
Authors:  ManickamAchari, V;  Bryce, RA;  Hashim, R;  Hashim, R (reprint author), Univ Malaya, Dept Chem, Kuala Lumpur 59100, Malaysia.
Favorite  |  View/Download:32/0  |  Submit date:2015/06/03
Carbohydrate Liquid-crystals  Thermotropic Phase-behavior  Branched-chain Glycosides  Particle Mesh Ewald  Molecular-dynamics  Synthetic Glycolipids  Phospholipid-bilayers  Physical-properties  Lyotropic Phases  Head Groups  
Structural, Dynamic, and Transport Properties of Concentrated Aqueous Sodium Chloride Solutions under an External Static Electric Field 期刊论文
JOURNAL OF PHYSICAL CHEMISTRY B, 2014, 卷号: 118, 期号: 16, 页码: 4404-4411
Authors:  Ren, G;  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.
Favorite  |  View/Download:25/0  |  Submit date:2015/06/03
Particle Mesh Ewald  Electrolyte-solutions  Osmotic Coefficients  Dielectric Friction  Molecular Simulation  Ionic Liquids  Monte-carlo  Water  Nacl  Thermodynamics  
Tuning the Self-Assembly of Short Peptides via Sequence Variations 期刊论文
LANGMUIR, 2013, 卷号: 29, 期号: 44, 页码: 13457-13464
Authors:  Zhao, YR;  Wang, JQ;  Deng, L;  Zhou, P;  Wang, SJ;  Wang, YT;  Xu, H;  Lu, JR;  Xu, H (reprint author), China Univ Petr East China, Ctr Bioengn & Biotechnol, 66 Changjiang West Rd, Qingdao 266580, Peoples R China.
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Particle Mesh Ewald  Biomimetic Synthesis  Potential Functions  Silica Nanotubes  Nanostructures  Amphiphiles  Molecules  Antibacterial  Membrane  Polymers  
Molecular Dynamics Study of Anhydrous Lamellar Structures of Synthetic Glycolipids: Effects of Chain Branching and Disaccharide Headgroup 期刊论文
JOURNAL OF PHYSICAL CHEMISTRY B, 2012, 卷号: 116, 期号: 38, 页码: 11626-11634
Authors:  Achari, VM;  Nguan, HS;  Heidelberg, T;  Bryce, RA;  Hashim, R;  Bryce, RA (reprint author), Univ Manchester, Sch Pharm & Pharmaceut Sci, Manchester M13 9PT, Lancs, England.
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Liquid-crystalline Glycosides  Deuterium Nmr Relaxation  Particle Mesh Ewald  Lipid-bilayer  Dodecyl Maltoside  Aqueous-solution  Phase-behavior  Alkyl Chains  Force-field  Simulations