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科研机构
北京大学 [362]
内容类型
期刊论文 [307]
其他 [52]
会议论文 [3]
发表日期
2017 [28]
2016 [48]
2015 [41]
2014 [41]
2013 [40]
2012 [40]
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专题:北京大学
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THE TRANSMISSION OF SYMMETRY IN LIQUID CRYSTALS
其他
2017-01-01
Xu, Jie
;
Zhang, Pingwen
收藏
  |  
浏览/下载:6/0
  |  
提交时间:2017/12/03
Liquid crystals
homogeneous phases
molecular symmetry
phase symmetry
SHEAR FLOWS
POLYMERS
EQUATION
SPHERE
T7 RNA polymerase translocation is facilitated by a helix opening on the fingers domain that may also prevent backtracking
期刊论文
NUCLEIC ACIDS RESEARCH, 2017
Da, Lin-Tai
;
E, Chao
;
Shuai, Yao
;
Wu, Shaogui
;
Su, Xiao-Dong
;
Yu, Jin
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  |  
浏览/下载:5/0
  |  
提交时间:2017/12/03
MARKOV STATE MODELS
MOLECULAR-DYNAMICS
STRUCTURAL BASIS
CONFORMATIONAL DYNAMICS
ELONGATION COMPLEXES
GENOME INSTABILITY
TRANSCRIPTION
TRANSITION
SIMULATIONS
INITIATION
Voltage Gating of a Biomimetic Nanopore: Electrowetting of a Hydrophobic Barrier
期刊论文
ACS NANO, 2017
Trick, Jemma L.
;
Song, Chen
;
Wallace, E. Jayne
;
Sansom, Mark S. P.
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  |  
浏览/下载:2/0
  |  
提交时间:2017/12/03
nanopore
membrane
hydrophobic barrier
electrowetting
molecular dynamics simulation
MOLECULAR-DYNAMICS SIMULATIONS
ASSEMBLING PEPTIDE NANOTUBES
PARTICLE MESH EWALD
ELECTRIC-FIELD
ION-CHANNEL
WATER PERMEATION
MECHANOSENSITIVE CHANNEL
MEMBRANE ELECTROPORATION
POTENTIAL FUNCTIONS
CARBON NANOTUBES
基于卤键的谢尔宾斯基三角分形自组装的模拟研究(英文)
期刊论文
物理化学学报, 2017
张珍
;
谢文俊
;
杨奕
;
孙耿
;
高毅勤
收藏
  |  
浏览/下载:13/0
  |  
提交时间:2017/12/03
自组装
蒙特卡罗模拟
分形
谢尔宾斯基三角形
催组装
Self-assembly
Monte carlo simulation
Fractal
Sierpinski triangle
Catassembly
SCANNING-TUNNELING-MICROSCOPY
COORDINATION SYSTEMS
NETWORKS
SURFACES
Polarization Effects on the Cellulose Dissolution in Ionic Liquids: Molecular Dynamics Simulations with Polarization Model and Integrated Tempering Enhanced Sampling Method
期刊论文
JOURNAL OF PHYSICAL CHEMISTRY B, 2017
Kan, Zigui
;
Zhu, Qang
;
Yang, Lijiang
;
Huang, Zhixiong
;
Jin, Biaobing
;
Ma, Jing
收藏
  |  
浏览/下载:4/0
  |  
提交时间:2017/12/03
1,3-DIMETHYLIMIDAZOLIUM CHLORIDE
GLUCOSE SOLVATION
FORCE-FIELDS
SOLVENTS
WATER
NMR
DEFINITION
POLAR
分子动力学方法模拟不同温度下铀酰在叶腊石上的吸附和扩散行为
期刊论文
物理化学学报, 2017
张陶娜
;
徐雪雯
;
董亮
;
谭昭怡
;
刘春立
收藏
  |  
浏览/下载:7/0
  |  
提交时间:2017/12/03
叶腊石
铀酰
分子动力学模拟
温度
吸附
扩散
Pyrophyllite
Uranyl
Molecular dynamic simulation
Temperature
Adsorption
Diffusion
NANOSIZED MINERAL FRACTURES
DENSITY-FUNCTIONAL MODEL
SURFACE COMPLEXATION
CARBONATE COMPLEXES
HUMIC-ACID
AQUEOUS-SOLUTION
WATER INTERFACE
FORCE-FIELD
VADOSE ZONE
KAOLINITE
Significantly Improved Protein Folding Thermodynamics Using a Dispersion-Corrected Water Model and a New Residue-Specific Force Field
期刊论文
JOURNAL OF PHYSICAL CHEMISTRY LETTERS, 2017
Wu, Hao-Nan
;
Jiang, Fan
;
Wu, Yun-Dong
收藏
  |  
浏览/下载:3/0
  |  
提交时间:2017/12/03
MOLECULAR-DYNAMICS SIMULATIONS
INTRINSICALLY DISORDERED PROTEINS
ALPHA-HELIX FORMATION
SIDE-CHAIN
BACKBONE PARAMETERS
AMBER FF99SB
PEPTIDES
COOPERATIVITY
ACCURACY
EXCHANGE
Modulating the phases of iron carbide nanoparticles: from a perspective of interfering with the carbon penetration of Fe@Fe3O4 by selectively adsorbed halide ions
期刊论文
CHEMICAL SCIENCE, 2017
Yang, Ziyu
;
Zhao, Tianshan
;
Huang, Xiaoxiao
;
Chu, Xin
;
Tang, Tianyu
;
Ju, Yanmin
;
Wang, Qian
;
Hou, Yanglong
;
Gao, Song
收藏
  |  
浏览/下载:12/0
  |  
提交时间:2017/12/03
FISCHER-TROPSCH SYNTHESIS
FE5C2 NANOPARTICLES
MULTIPLET STRUCTURE
MAGNETIC-PROPERTIES
CHEMICAL-SYNTHESIS
FE NANOPARTICLES
VACANCY LEVELS
XPS SPECTRA
NANOCRYSTALS
MONODISPERSE
Mechanism of Phosphorylation-Induced Folding of 4E-BP2 Revealed by Molecular Dynamics Simulations
期刊论文
JOURNAL OF CHEMICAL THEORY AND COMPUTATION, 2017
Zeng, Juan
;
Jiang, Fan
;
Wu, Yun-Doug
收藏
  |  
浏览/下载:4/0
  |  
提交时间:2017/12/03
CAP-DEPENDENT TRANSLATION
LINEAR CONSTRAINT SOLVER
FORCE-FIELD
CONFORMATIONAL SWITCH
TRP-CAGE
POSTTRANSLATIONAL MODIFICATIONS
PROTEIN-PHOSPHORYLATION
DISORDERED PROTEIN
DENATURED STATE
HYDROGEN-BONDS
Single Mutations Reshape the Structural Correlation Network of the DMXAA-Human STING Complex
期刊论文
JOURNAL OF PHYSICAL CHEMISTRY B, 2017
Che, Xing
;
Du, Xiao-Xia
;
Cai, Xiaoxia
;
Zhang, Jun
;
Xie, Wen Jun
;
Long, Zhuoran
;
Ye, Zhao-Yang
;
Zhang, Heng
;
Yang, Lijiang
;
Su, Xiao-Dong
;
Gao, Yi Qin
收藏
  |  
浏览/下载:8/0
  |  
提交时间:2017/12/03
MOLECULAR-DYNAMICS SIMULATIONS
PROTEIN-LIGAND BINDING
2-PHASE THERMODYNAMIC MODEL
WATER-MEDIATED INTERACTIONS
CYCLIC DI-GMP
FREE-ENERGY
ENTROPY
DNA
COMPENSATION
RECOGNITION
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