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北京大学 [2]
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期刊论文 [12]
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浏览/检索结果:
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CHARMM-GUI Membrane Builder for Complex Biological Membrane Simulations with Glycolipids and Lipoglycans
期刊论文
JOURNAL OF CHEMICAL THEORY AND COMPUTATION, 2019, 卷号: 15, 期号: 1, 页码: 775-786
作者:
Lee, Jumin
;
Patel, Dhilon S.
;
Stahle, Jonas
;
Park, Sang-Jun
;
Kern, Nathan R.
收藏
  |  
浏览/下载:26/0
  |  
提交时间:2020/07/01
Super-resolution imaging in glycoscience: new developments and challenges
期刊论文
Journal of innovative optical health sciences, 2016, 卷号: 9, 期号: 3, 页码: 16
作者:
Chen, Junling
;
Tong, Ti
;
Wang, Hongda
收藏
  |  
浏览/下载:21/0
  |  
提交时间:2019/05/09
Carbohydrate
Super-resolution imaging
Force fields and scoring functions for carbohydrate simulation
期刊论文
CARBOHYDRATE RESEARCH, 2015, 卷号: 401, 页码: 73-81
作者:
Xiong, Xiuming
;
Chen, Zhaoqiang
;
Cossins, Benjamin P.
;
Xu, Zhijian
;
Shao, Qiang
收藏
  |  
浏览/下载:21/0
  |  
提交时间:2019/01/08
Carbohydrate force field
Scoring function
Simulation
Drug design
Carbohydrate-protein interaction
Docking polysaccharide to proteins that have a Tryptophan box in the binding pocket
期刊论文
CARBOHYDRATE RESEARCH, 2015, 卷号: 414
作者:
Yang, Yian
;
Qian, Jiaqiang
;
Ming, Dengming
收藏
  |  
浏览/下载:10/0
  |  
提交时间:2019/12/19
Polysaccharide-protein interactions
Tryptophan box
Knowledge-based force field
Monte Carlo simulated annealing
The Slowdown of the Endoglucanase Trichoderma reesei Cel5A-Catalyzed Cellulose Hydrolysis Is Related to Its Initial Activity
期刊论文
BIOCHEMISTRY, 2014, 卷号: 53, 期号: 48, 页码: 7650-7658
作者:
Shu, Zhiyu
;
Wang, Yefei
;
An, Liaoyuan
;
Yao, Lishan
收藏
  |  
浏览/下载:18/0
  |  
提交时间:2015/11/02
How Solvent Influences the Anomeric Effect: Roles of Hyperconjugative versus Steric Interactions on the Conformational Preference
期刊论文
http://dx.doi.org/10.1021/jo402306e, 2014
Wang, Changwei
;
Ying, Fuming
;
Wu, Wei
;
Mo, Yirong
;
吴玮
;
莫亦荣
收藏
  |  
浏览/下载:6/0
  |  
提交时间:2015/07/22
LOCALIZED MOLECULAR-ORBITALS
GROUP-FUNCTION APPROXIMATION
ADJACENT ELECTRON PAIRS
MECHANICS FORCE-FIELD
GAS-PHASE
INTERMOLECULAR INTERACTIONS
THEORETICAL-ANALYSIS
POLYATOMIC SYSTEMS
AQUEOUS-SOLUTION
SELF-CONSISTENT
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
Nguan, H
;
Ahmadi, S
;
Hashim, R
收藏
  |  
浏览/下载:17/0
  |  
提交时间: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
Effects of anionic structure on the dissolution of cellulose in ionic liquids revealed by molecular simulation
期刊论文
CARBOHYDRATE POLYMERS, 2013, 卷号: 94, 期号: 2, 页码: 723-730
作者:
Zhao, Yuling
;
Liu, Xiaomin
;
Wang, Jianji
;
Zhang, Suojiang
收藏
  |  
浏览/下载:11/0
  |  
提交时间:2015/05/05
Ionic liquids
Cellulose dissolution
Molecular dynamics simulation
Anionic structure
Hydrogen bond
Forced Dissociation of Selectin-ligand Complexes Using Steered Molecular Dynamics Simulation
期刊论文
MCB, 2005, 卷号: 2, 期号: 4, 页码: 161-177
作者:
Lv SQ(吕守芹)
;
Long M(龙勉)
收藏
  |  
浏览/下载:1215/171
  |  
提交时间:2007/06/15
Analysis of protein-carbohydrate interaction at the lower size limit of the protein part (15-mer peptide) by NMR spectroscopy, electrospray ionization mass spectrometry, and molecular modeling
期刊论文
biochemistry us, 2002
Siebert, HC
;
Lu, SY
;
Frank, M
;
Kramer, J
;
Wechselberger, R
;
Joosten, J
;
Andre, S
;
Rittenhouse-Olson, K
;
Roy, R
;
von der Lieth, CW
;
Kaptein, R
;
Vliegenthart, JFG
;
Heck, AJR
;
Gabius, HJ
收藏
  |  
浏览/下载:5/0
  |  
提交时间:2015/11/11
DYNAMIC NUCLEAR-POLARIZATION
ANTIBODY-BINDING PROPERTIES
CELL-ADHESION MOLECULES
RANA-CATESBEIANA EGGS
T-ANTIGEN
HEVEIN DOMAINS
PEANUT LECTIN
FORCE-FIELD
3-DIMENSIONAL STRUCTURE
CONFORMER SELECTION
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