国家自然科学基金(LY12B07013)

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相关期刊:《Chinese Journal of Structural Chemistry》更多>>
相关主题:QSPRANALYSISPOLYCHLORINATEDTHEORETICALDIPHENYL更多>>
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QSPR Studies on the Physicochemical Properties of Polychlorinated Diphenyl Sulfides——The Application of Theoretical Descriptors Derived from Electrostatic Potentials on Molecular Surface
《Chinese Journal of Structural Chemistry》2015年第7期995-1003,共9页王维 许惠英 周侣艳 唐东跃 
Supported by the Natural Science Foundation of Zhejiang Province(LY12B07013);the Education Research Project of Zhejiang Provincial Department(Y201329851)
Based on the relationship between the quantitative structure and property(QSPR) of organic compounds, the surface electrostatic potential parameters of 29 polychlorinated diphenyl sulfides(PCDPSs) with experimenta...
关键词:polychlorinated diphenyl sulfides(PCDPSs) molecular electrostatic potential physicochemical property QSPR 
QSPR Analysis of the Physicochemical Properties for Phthalic Acid Esters
《Chinese Journal of Structural Chemistry》2013年第12期1880-1884,共5页XU Hui-Ying SHU Tian-Ge WANG Wei ZHU Jian-Qing LU Yin XU Xiao-Lu WU Gang 
Supported by the Natural Science Foundation of Zhejiang Province(LY12B07013,LY12C03009);Public Technology Research Project(Analysis and Measurement)of Zhejiang Province(2013C37098);Science and Technology Project of Zhejiang Province(2009C33163)
Based on quantitative structure-property relationship (QSPR) of organic compounds, the molecular connectivity indices of 21 phthalic acid ester compounds were extracted. Relationship between the physicochemical prop...
关键词:phthalic acid esters molecular connectivity index physicochemical property QSPR 
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