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期刊论文 [31]
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Towards potentiometric detection in nonaqueous media: Evaluation of the impacts of organic solvents on polymeric membrane ion-selective electrodes
期刊论文
TALANTA, 2022, 卷号: 241, 页码: 9
作者:
Lin, Zhaoyang
;
Liang, Rongning
;
Qin, Wei
收藏
  |  
浏览/下载:1/0
  |  
提交时间:2024/05/07
Polymeric membrane ion-selective electrode
Water-miscible organic solvent
Nonaqueous sample
Potentiometric detection
The effects of implicit modeling of nonpolar solvation on protein folding simulations
期刊论文
PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2018, 卷号: 20, 期号: 27, 页码: 18410-18419
作者:
Shao, Qiang
;
Zhu, Weiliang
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  |  
浏览/下载:8/0
  |  
提交时间:2019/01/08
Computational prediction of cellulose solubilities in ionic liquids based on COSMO-RS
期刊论文
FLUID PHASE EQUILIBRIA, 2018, 卷号: 475, 页码: 25
作者:
Chu, YH
;
Zhang, XP
;
Hillestad, M
;
He, XZ
;
Chu, Yunhan
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  |  
浏览/下载:63/0
  |  
提交时间:2018/12/29
Ionic Liquids
Experimental-verification
Cellulose Solubility
Activity-coefficients
Cosmo-rs
Molecular-dynamics
Activity Coefficient
Screening Model
Excess Enthalpy
Force-field
Dissolution
Solvation
Chloride
Chemistry
Simulations
Ion Pairing in Alkali Nitrate Electrolyte Solutions
期刊论文
JOURNAL OF PHYSICAL CHEMISTRY B, 2016
Xie, Wen Jun
;
Zhang, Zhen
;
Gao, Yi Qin
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浏览/下载:2/0
  |  
提交时间:2017/12/03
MOLECULAR-DYNAMICS
AQUEOUS-SOLUTIONS
HOFMEISTER SERIES
SIMULATION
WATER
CRYSTALLIZATION
HYDRATION
POLARIZATION
MONOVALENT
SOLVATION
Thermodynamic modeling of electrolyte solutions by a hybrid ion-interaction and solvation (HIS) model
期刊论文
2015
Ge, Xinlei
;
Wang, Junfeng
;
Zhang, Zuotai
;
Wang, Xidong
;
Chen, Mindong
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  |  
浏览/下载:5/0
  |  
提交时间:2015/11/11
Electrolyte solutions
Phase equilibrium
Thermodynamic properties
Activity coefficient
MEAN SPHERICAL APPROXIMATION
LOCAL COMPOSITION MODEL
TEMPERATURE 298.15 K
ADSORPTION-ISOTHERM MODEL
MODIFIED PITZER EQUATION
SOLID-LIQUID EQUILIBRIA
EXCESS GIBBS ENERGY
EMMETT-TELLER BET
3-CHARACTERISTIC-PARAMETER CORRELATION MODEL
MODIFIED BROMLEYS METHODOLOGY
Volumetric Properties and Molecular Interactions of Binary Mixtures Imidazolium Acetates-ethanol at 293. 15 K
期刊论文
CHEMICAL JOURNAL OF CHINESE UNIVERSITIES-CHINESE, 2014, 卷号: 35, 期号: [db:dc_citation_issue], 页码: 121-126
作者:
Hou Haiyun
;
Huang Yinrong
;
Bai Bofeng
;
Yang Jing
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  |  
浏览/下载:8/0
  |  
提交时间:2019/12/02
Apparent molar volume
[Mim]Ac/[Mmim]Ac/[Emim]Ac-EtOH
Molecular interaction
Excess molar volume
Solvation coefficient
First-Principles Molecular Dynamics Simulation of Atmospherically Relevant Anion Solvation in Supercooled Water Droplet
期刊论文
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 2013, 卷号: 135, 期号: 41, 页码: 15549
Zhao, Yu
;
Li, Hui
;
Zeng, Xiao Cheng
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  |  
浏览/下载:28/0
  |  
提交时间:2014/01/17
Nonfitting protein-ligand interaction scoring function based on first-principles theoretical chemistry methods: Development and application on kinase inhibitors
期刊论文
http://dx.doi.org/10.1002/jcc.23303, 2013
Rao, Li
;
Zhang, Igor Ying
;
Guo, Wenping
;
Feng, Li
;
Meggers, Eric
;
Xu, Xin
;
徐昕
;
ERIC MEGGERS
收藏
  |  
浏览/下载:5/0
  |  
提交时间:2015/07/22
QUANTUM MECHANICS/MOLECULAR MECHANICS
MOLECULAR-ORBITAL METHODS
EXTENDED ONIOM METHOD
2 CDK2 INHIBITORS
THERMOCHEMICAL KINETICS
DENSITY FUNCTIONALS
TRANSITION-ELEMENTS
GUANINE DERIVATIVES
ORGANIC-MOLECULES
BINDING
Simple Theory for Salt Effects on the Solubility of Amide
期刊论文
journal of physical chemistry b, 2012
Gao, Yi Qin
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  |  
浏览/下载:5/0
  |  
提交时间:2015/11/10
ACETYLTETRAGLYCINE ETHYL ESTER
INDUCED PROTEIN DENATURATION
HOFMEISTER ION INTERACTIONS
TRIMETHYLAMINE-N-OXIDE
AQUEOUS UREA SOLUTIONS
TETRAMETHYLAMMONIUM CHLORIDE
PREFERENTIAL INTERACTIONS
MOLECULAR-DYNAMICS
WATER-STRUCTURE
BIOLOGICAL MACROMOLECULES
THE UNIQUE PROPERTIES OF THE SOLID-LIKE CONFINED LIQUID FILMS: A LARGE SCALE MOLECULAR DYNAMICS SIMULATION APPROACH
期刊论文
Acta Mechanica Solida Sinica, 2011, 卷号: 24, 期号: 2, 页码: 101-116
作者:
王奉超(Wang FC)
;
赵亚溥(Zhao YP)
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  |  
浏览/下载:20/0
  |  
提交时间:2012/04/01
Confined Liquid
Solid-Like
Shear-Thinning
Slip
Large Scale Molecular Dynamics Simulation
Thin-Films
Rheological Properties
Solvation Forces
Surfaces
Slip
Hexadecane
Shear
Flow
Solidification
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