CAS OpenIR  > 中科院上海应用物理研究所2011-2018年
Comparisons of Criteria for Analyzing the Dynamical Association of Solutes in Aqueous Solutions
Zhao, L; Tu, YS; Wang, CL; Fang, HP; Tu, YS (reprint author), Yangzhou Univ, Coll Phys Sci & Technol, Yangzhou 225009, Jiangsu, Peoples R China.
2016
Source PublicationCHINESE PHYSICS LETTERS
ISSN0256-307X
Volume33Issue:3Pages:
Subtype期刊文献
AbstractHow to determine accurately the association states of solutes in aqueous systems is of fundamental importance in a variety of chemical, physical, and biological processes. We apply four widely used criteria to analyze the dynamic association processes of solutes, e.g., amphiphilic molecules, and to find the inappropriate selections of representative sites on solutes in these criteria may bring about appreciable influence on the estimation of dynamic association behaviors such as unrealistic packing radii and even misleading packing structures. It would be better to select dynamically representative sites on solute molecules based on the characteristic of solute associations. Our detailed discussions give a guide on how to determine an appropriate criterion to accurately analyze the association behaviors of solute molecules in aqueous solutions.
KeywordMolecular-dynamics Aggregation Nanoparticles Simulation Protein Kinetics Challenges Nucleation Dispersion Particles
DOI10.1088/0256-307X/33/3/038201
Indexed BySCI
Language英语
WOS IDWOS:000374647900031
Citation statistics
Cited Times:1[WOS]   [WOS Record]     [Related Records in WOS]
Document Type期刊论文
Identifierhttp://ir.sinap.ac.cn/handle/331007/25666
Collection中科院上海应用物理研究所2011-2018年
Corresponding AuthorTu, YS (reprint author), Yangzhou Univ, Coll Phys Sci & Technol, Yangzhou 225009, Jiangsu, Peoples R China.
Recommended Citation
GB/T 7714
Zhao, L,Tu, YS,Wang, CL,et al. Comparisons of Criteria for Analyzing the Dynamical Association of Solutes in Aqueous Solutions[J]. CHINESE PHYSICS LETTERS,2016,33(3):—.
APA Zhao, L,Tu, YS,Wang, CL,Fang, HP,&Tu, YS .(2016).Comparisons of Criteria for Analyzing the Dynamical Association of Solutes in Aqueous Solutions.CHINESE PHYSICS LETTERS,33(3),—.
MLA Zhao, L,et al."Comparisons of Criteria for Analyzing the Dynamical Association of Solutes in Aqueous Solutions".CHINESE PHYSICS LETTERS 33.3(2016):—.
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