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上海药物研究所 [2]
理论物理研究所 [1]
长春光学精密机械与物... [1]
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期刊论文 [6]
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Electrostatic potentials of camptothecin and its analogues
期刊论文
OAI收割
THEORETICAL CHEMISTRY ACCOUNTS, 2014, 卷号: 133, 期号: 10
作者:
Lei, Jianyong
;
Chen, Yun
;
Feng, Xuejun
;
Jin, Jian
;
Gu, Jiande
  |  
收藏
  |  
浏览/下载:25/0
  |  
提交时间:2019/01/08
Electrostatic potentials
Camptothecin
pi-pi Interaction
One-Dimensional Steady Transport by Molecular Dynamics Simulation: Non-Boltzmann Position Distribution and Non-Arrhenius Dynamical Behavior
期刊论文
OAI收割
COMMUNICATIONS IN THEORETICAL PHYSICS, 2014, 卷号: 62, 期号: 4, 页码: 579-588
作者:
Wang, YT
收藏
  |  
浏览/下载:36/0
  |  
提交时间:2015/06/03
TILTED PERIODIC POTENTIALS
TEMPERATURE IONIC LIQUIDS
MOLTEN SODIUM-CHLORIDE
ELECTROSTATIC FIELDS
ELECTRIC-FIELD
NONEQUILIBRIUM TRAJECTORIES
DIFFUSION-COEFFICIENTS
CONDUCTIVITY SPECTRA
POLYMER ELECTROLYTES
ELECTROPHORETIC NMR
Probing the Primary Mechanisms Affecting the Environmental Distribution of Estrogen and Androgen Isomers
期刊论文
OAI收割
ENVIRONMENTAL SCIENCE & TECHNOLOGY, 2011, 卷号: 45, 期号: 9, 页码: 3989-3995
作者:
Qiao, Xianliang
;
Carmosini, Nadia
;
Li, Fei
;
Lee, Linda S.
  |  
收藏
  |  
浏览/下载:25/0
  |  
提交时间:2011/07/22
Water Partition-coefficients
Solvation Energy Relationships
Solid-phase Microextraction
Organic-matter
Electrostatic Potentials
Theoretical Descriptors
Relevant Concentrations
Solubility Enhancement
Melengestrol Acetate
Growth Promoters
Configuring an electrostatic membrane reflector with potentials exerted on distributed electrodes (EI CONFERENCE)
会议论文
OAI收割
2009 IEEE International Conference on Mechatronics and Automation, ICMA 2009, August 9, 2009 - August 12, 2009, Changchun, China
作者:
Zhang P.
;
Shi G.
收藏
  |  
浏览/下载:24/0
  |  
提交时间:2013/03/25
Electrostatic membrane reflector (EMR) is very promised for optical quality application with the merits of utra-lightweight and flexible. Configuring a circular membrane reflector with electrostatic potentials exerted on distributed electrodes can approximatively produce a parabolic shape. A 300mm EMR (made from polyimide) stretched by distributed electrodes below is designed
and the number of concentric electrodes needed for membrane shape forming is analysed. First
based on an analytical solution of Poisson's equation
determine the membrane control matrix by finding influence functions of 3 concentric electrodes and 6 control points on membrane surface in order to compute the needed voltages exerted on the distributed electrodes by the method of least-squares fitting. Then the final shape solved by finite element analysis with ANSYS is contrasted with the paraboloid and deviates greatly when the central displacement of membrane is beyond 2.5mm
but in this range increasing the number of electrodes and control points will get a better shape. The corresponding errors are analyzed
and the control method is concluded. Only using the integrated method of analytical computation
numerical analysis and experiment
the membrane shape of certain central displacement can be exactly predicted and controlled. 2009 IEEE.
Three-dimensional lanthanide(III)-copper(II) compounds based on an unsymmetrical 2-pyridylphosphonate ligand: An experimental and theoretical study
期刊论文
OAI收割
Chemistry-a European Journal, 2007, 卷号: 13, 期号: 17, 页码: 4759-4769
Y. S. Ma
;
H. Li
;
J. J. Wang
;
S. S. Bao
;
R. Cao
;
Y. Z. Li
;
J. Ma
;
L. M. Zheng
收藏
  |  
浏览/下载:27/0
  |  
提交时间:2013/04/01
copper
N
hydrothermal synthesis
O
lanthanides
magnetic
properties
ligands
single-molecule magnet
universal force-field
lamellar lanthanide
phosphonates
initio structure determination
srsi2 topological type
frameworks mil-n
ii/gd-iii couple
electrostatic potentials
hydrothermal synthesis
coordination polymers
Structural analysis of human CCR2b and primate CCR2b by molecular modeling and molecular dynamics simulation
期刊论文
OAI收割
JOURNAL OF MOLECULAR MODELING, 2002, 卷号: 8, 期号: 7, 页码: 217-222
作者:
Shi XF
;
Liu SX[*]
;
Xiangyu JS
;
Zhang YP
;
Huang JF
收藏
  |  
浏览/下载:11/0
  |  
提交时间:2010/08/24
CCR2 structure
Molecular dynamics
Electrostatic potentials