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Molecular dynamics simulations of the lyotropic reverse hexagonal (H-II) of Guerbet branched-chain beta-D-glucoside 期刊论文
PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2014, 卷号: 16, 期号: 1, 页码: 324-334
Authors:  Nguan, H;  Ahmadi, S;  Hashim, R;  Hashim, R (reprint author), Univ Malaya, Dept Chem, Fac Sci, Kuala Lumpur 50603, Malaysia.
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X-ray-diffraction  Liver Microsomal-membranes  Liquid-crystalline Phases  Sodium Dodecyl-sulfate  Synthetic Glycolipids  Astonishing Diversity  Natural Surfactants  Aqueous-solution  Force-field  Hii Phase  
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.
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Carbohydrate Liquid-crystals  Thermotropic Phase-behavior  Branched-chain Glycosides  Particle Mesh Ewald  Molecular-dynamics  Synthetic Glycolipids  Phospholipid-bilayers  Physical-properties  Lyotropic Phases  Head Groups  
AIM and NBO analyses on hydrogen bonds formation in sugar-based surfactants (alpha/beta-d-mannose and n-octyl-alpha/beta-d-mannopyranoside): a density functional theory study 期刊论文
LIQUID CRYSTALS, 2014, 卷号: 41, 期号: 6, 页码: 784-792
Authors:  Kotena, ZM;  Behjatmanesh-Ardakani, R;  Hashim, R;  Kotena, ZM (reprint author), Univ Malaya, Dept Chem, Fac Sci, Kuala Lumpur 59100, Malaysia.
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Molecular-orbital Methods  b3lyp/6-311++g-asterisk-asterisk Level  Electron-density  Dft  Glucopyranoside  Glycosides  Proteins  Clusters  Behavior  Hardness  
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