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SCI期刊论文 [14]
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Constructing effective energy functions for protein structure prediction through broadening attraction-basin and reverse Monte Carlo sampling
会议论文
BMC BIOINFORMATICS, Wuhan, PEOPLES R CHINA, JAN 14-16, 2019
Authors:
Wang, C
;
Wei, Y
;
Zhang, HC
;
Kong, LP
;
Sun, SW
;
Zheng, WM
;
Bu, DB
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Submit date:2019/07/24
TERTIARY STRUCTURES
FRAGMENTS
Constructing effective energy functions for protein structure prediction through broadening attraction-basin and reverse Monte Carlo sampling
期刊论文
BMC BIOINFORMATICS, 2019, 卷号: 20, 页码: 135
Authors:
Wang, C
;
Wei, Y
;
Zhang, HC
;
Kong, LP
;
Sun, SW
;
Zheng, WM
;
Bu, DB
Adobe PDF(1618Kb)
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Submit date:2019/07/19
TERTIARY STRUCTURES
FRAGMENTS
Phase Behaviors of Ionic Liquids Heating from Different Crystal Polymorphs toward the Same Smectic-A Ionic Liquid Crystal by Molecular Dynamics Simulation
期刊论文
CRYSTALS, 2019, 卷号: 9, 期号: 1, 页码: 26
Authors:
Cao, WD
;
Wang, YT
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Submit date:2019/07/19
SPATIAL HETEROGENEITY
ATOMIC CHARGES
CHAIN-LENGTH
TRANSITION
INSIGHTS
DIFFUSION
STATE
Comparing NMR and X-ray protein structure: Lindemann-like parameters and NMR disorder
期刊论文
JOURNAL OF BIOMOLECULAR STRUCTURE & DYNAMICS, 2018, 卷号: 36, 期号: 9, 页码: 2331-2341
Authors:
Faraggi, E
;
Dunker, AK
;
Sussman, JL
;
Kloczkowski, A
Adobe PDF(703Kb)
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Submit date:2018/12/27
BACKBONE TORSION ANGLES
MAJOR URINARY PROTEIN
INTRINSIC DISORDER
STRUCTURE PREDICTION
SECONDARY STRUCTURE
CRYSTAL-STRUCTURE
DYNAMICS
DIFFRACTION
CRYSTALLOGRAPHY
RECOGNITION
Anchor Effect of Interactions Between Kinesin's Nucleotide-Binding Pocket and Microtubule
期刊论文
CELLULAR AND MOLECULAR BIOENGINEERING, 2017, 卷号: 10, 期号: 2, 页码: 162-173
Authors:
Jin, YM
;
Geng, YZ
;
Lu, LN
;
Ma, YL
;
Lu, G
;
Zhang, H
;
Ji, Q
;
Geng, YZ (reprint author), Hebei Univ Technol, Sch Sci, Tianjin 300401, Peoples R China.
;
Ji, Q (reprint author), Chinese Acad Sci, Inst Theoret Phys, State Key Lab Theoret Phys, Beijing 100190, Peoples R China.
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Submit date:2017/12/21
Kinesin
Microtubule
Nucleotide-binding Pocket
Anchor Effect
Improving protein fold recognition by extracting fold-specific features from predicted residue-residue contacts
期刊论文
BIOINFORMATICS, 2017, 卷号: 33, 期号: 23, 页码: 3749-3757
Authors:
Zhu, JW
;
Zhang, HC
;
Li, SC
;
Wang, C
;
Kong, LP
;
Sun, SW
;
Zheng, WM
;
Bu, DB
;
Bu, DB (reprint author), Chinese Acad Sci, Inst Comp Technol, Key Lab Intelligent Informat Proc, Beijing 100190, Peoples R China.
;
Zheng, WM (reprint author), Chinese Acad Sci, Inst Theoret Phys, Beijing 100190, Peoples R China.
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Submit date:2017/12/21
F-1-ATPase Stabilizes and Positions Adenosine Triphosphate Revealed by Molecular Dynamics Simulations
期刊论文
ACTA PHYSICO-CHIMICA SINICA, 2015, 卷号: 31, 期号: 9, 页码: 1803-1809
Authors:
Wu, SG
;
Gao, XT
;
Li, Q
;
Liao, J
;
Xu, CG
;
Wu, SG (reprint author), Sichuan Normal Univ, Coll Chem & Mat Sci, Chengdu 610068, Peoples R China.
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Submit date:2016/11/21
F-1-atpase
Hydrogen Bond
Molecular Dynamics
Mutation
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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Submit date:2014/04/25
X-ray-diffraction
Liver Microsomal-membranes
Liquid-crystalline Phases
Sodium Dodecyl-sulfate
Synthetic Glycolipids
Astonishing Diversity
Natural Surfactants
Aqueous-solution
Force-field
Hii Phase
Formation and dissociation of protonated cytosine-cytosine base pairs in i-motifs by ab initio quantum chemical calculations
期刊论文
CHINESE PHYSICS B, 2014, 卷号: 23, 期号: 2, 页码: 20702
Authors:
Zhang, XH
;
Li, M
;
Wang, YT
;
Ouyang, ZC
;
Wang, YT (reprint author), Chinese Acad Sci, Inst Theoret Phys, State Key Lab Theoret Phys, Beijing 100190, Peoples R China.
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Submit date:2014/04/25
Crystal-structure
Gas-phase
Dna
Dynamics
Telomere
Strand
Shear-induced domain deformation in a tilted lipid monolayer: From circle to ellipse and kinked stripe
期刊论文
PHYSICAL REVIEW E, 2008, 卷号: 78, 期号: 5, 页码: -
Authors:
Iwamoto, Mitsumasa
;
Yamamoto, Tetsuya
;
Liu, Fei
;
Ou-Yang, Zhong-Can
;
Iwamoto, M , Tokyo Inst Technol, Dept Phys Elect, Meguro Ku, 2-12-1 S3-33 O Okayama, Tokyo 1528552, Japan
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Submit date:2012/08/02
Air-water-interface
X-ray-diffraction
Langmuir Monolayers
Phase-transitions
Fluorescence Microscopy
Molecular-orientation
Polar-molecules
Liquid-crystals
Flow
Relaxation