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湖南大学 [32]
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会议论文 [32]
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共32条,第1-10条
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内容类型:会议论文
专题:湖南大学
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Microscopic mechanism of the interaction between water and formic acid-sodium chloride aerosol
会议论文
Powder Technology, 46-57, 2019
作者:
Chao Zhang
;
Yueshe Wang
;
Haijun Wang
;
Yang Yang
;
Chenpei Li
收藏
  |  
浏览/下载:8/0
  |  
提交时间:2019/12/13
Aerosol
Organic
Structure
Hygroscopic
properties
Molecular
dynamics
simulation
Atomic simulations of effect on thermal conductivity of ion-irradiated graphene
会议论文
Physica B: Condensed Matter, 40-44, 2019
作者:
Jinjie Gu
;
Lirong Huang
;
Weiqi Shi
收藏
  |  
浏览/下载:0/0
  |  
提交时间:2019/12/13
Graphene
Ion
irradiation
Molecular
dynamics
simulation
Defect
Thermal
conductivity
Mitochondrial ATP-sensitive potassium channel regulates mitochondrial dynamics to participate in neurodegeneration of Parkinson's disease
会议论文
BIOCHIMICA ET BIOPHYSICA ACTA-MOLECULAR BASIS OF DISEASE, 1086-1103, 2018
作者:
Kaige Peng
;
Jun Hu
;
Jingsong Xiao
;
Guorong Dan
;
Likui Yang
收藏
  |  
浏览/下载:11/0
  |  
提交时间:2019/12/25
Parkinson's
disease
mitoKATP
channel
Rotenone
Kir6.1
Mitochondrial
biogenesis
Mitochondrial
fission/fusion
Electric Field Intensity Effects on the Microstructural Characteristics Evolution of Methyl Vinyl Silicone Rubber via Molecular Simulation
会议论文
MOLECULES, 2018
作者:
Liang, Ying
;
Gao, Ting
;
Wang, Xiangnian
;
Sun, Mengting
;
Gao, Lijuan
收藏
  |  
浏览/下载:1/0
  |  
提交时间:2019/12/25
composite
insulator
methyl
vinyl
silicone
rubber
molecular
dynamics
electric
field
elastic
modulus
Effect of Fluorination on Friction Forces between Concentrated Polymer Brushes in the Dry State: All-atom Molecular Dynamics Simulation Study
会议论文
Chem. Lett., 784-786, 2018
作者:
Uehara Shuichi
;
Liu Zhongmin
;
Xu Jingxiang
;
Ootani Yusuke
;
Ozawa Nobuki
收藏
  |  
浏览/下载:0/0
  |  
提交时间:2019/12/25
Polymer
brush
Friction
Molecular
dynamics
simulation
Ion effect on the dynamics of water hydrogen bonding network: A theoretical and computational spectroscopy point of view
会议论文
WILEY INTERDISCIPLINARY REVIEWS-COMPUTATIONAL MOLECULAR SCIENCE, 2018
作者:
Zhang, Qiang
;
Pan, Zhijun
;
Zhang, Lu
;
Zhang, Ruiting
;
Chen, Zhening
收藏
  |  
浏览/下载:1/0
  |  
提交时间:2019/12/25
hydrogen
bond
relaxation
ion
effect
ionic
solution
jump
reorientation
molecular
dynamic
simulation
nonlinear
spectroscopy
Computational chemical biology and drug design: Facilitating protein structure, function, and modulation studies
会议论文
MEDICINAL RESEARCH REVIEWS, 914-950, 2018
作者:
Zheng, MY
;
Zhao, JH
;
Cui, C
;
Fu, ZY
;
Li, XT
收藏
  |  
浏览/下载:2/0
  |  
提交时间:2019/12/25
ADMET
chemical
biology
drug
design
in
silico
lead
optimization
molecular
dynamics
polypharmacology
virtual
screening
Noble metal-free upgrading of multi-unsaturated biomass derivatives at room temperature: silyl species enable reactivity
会议论文
Green Chemistry, 5327-5335, 2018
作者:
Hu Li
;
Wenfeng Zhao
;
Wenshuai Dai
;
Jingxuan Long
;
Masaru Watanabe
收藏
  |  
浏览/下载:0/0
  |  
提交时间:2019/12/25
Analysis of Sub-threshold Electron Transport Properties of Ultra-scaled Amorphous Phase Change Material Germanium Telluride
会议论文
2017 IEEE 12TH INTERNATIONAL CONFERENCE ON ASIC (ASICON), 480-483, 2017
作者:
Liu, J
;
Anantram, MP
;
Xu, X
;
Lu, JW
收藏
  |  
浏览/下载:7/0
  |  
提交时间:2019/12/26
phase change material (PCM)
amorphous germanium telluride (a-GeTe)
non-equilibrium Green's function
density functional theory (DFT)
ab-initio molecular dynamics (AIMD)
sub-threshold quantum transport
electron-phonon scattering
Molecular dynamics simulations of the structure evolutions of Cu-Zr metallic glasses under irradiation.
会议论文
Nuclear Instruments & Methods in Physics Research Section B, 77-81, 2017
作者:
Lang, Lin
;
Tian, Zean
;
Xiao, Shifang
;
Deng, Huiqiu
;
Ao, Bingyun
收藏
  |  
浏览/下载:1/0
  |  
提交时间:2019/12/26
Irradiation
Metallic glass
Molecular dynamics simulation
Structure evolution
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