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Electronegativity Topologic Index - A New Method for Numerization of Structural Information
Alternative TitleActa Phys.-Chim. Sin.
Zhou Jiaju; Xie Guirong; Xie Qian; Sun Hongmei; Feng Jun; Xu Zhihong
1995
Source PublicationACTA PHYSICO-CHIMICA SINICA
ISSN1000-6818
Volume11Issue:9Pages:777-780
AbstractElectronegativity topologic index (ETI) method has been proposed for the numerization of structural information. The use of group electronegativity (ETI0) in ETI is more reasonable than that of the intrinsic state. term used in the E-state model, The Ern method can be used for direct description of molecular structure information in atom level. Application example showed that the ETI method in combination with artificial neural network and regression to build QSAR model was suitable for sonic systems.; Electronegativity topologic index (ETI) method has been proposed for the numerization of structural information. The use of group electronegativity (ETI0) in ETI is more reasonable than that of the intrinsic state. term used in the E-state model, The Ern method can be used for direct description of molecular structure information in atom level. Application example showed that the ETI method in combination with artificial neural network and regression to build QSAR model was suitable for sonic systems.
KeywordNumerization Of Structural Information Eti Ann Qsar
SubtypeArticle
WOS HeadingsScience & Technology ; Physical Sciences
DOI10.3866/PKU.WHXB19950903
URL查看原文
Indexed BySCI
Language英语
WOS Research AreaChemistry
WOS SubjectChemistry, Physical
WOS IDWOS:000207590800003
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Document Type期刊论文
Version出版稿
Identifierhttp://ir.ipe.ac.cn/handle/122111/5912
Collection研究所(批量导入)
AffiliationChinese Acad Sci, Lab Comp Chem, Inst Chem Met, Beijing 100080, Peoples R China
Recommended Citation
GB/T 7714
Zhou Jiaju,Xie Guirong,Xie Qian,et al. Electronegativity Topologic Index - A New Method for Numerization of Structural Information[J]. ACTA PHYSICO-CHIMICA SINICA,1995,11(9):777-780.
APA Zhou Jiaju,Xie Guirong,Xie Qian,Sun Hongmei,Feng Jun,&Xu Zhihong.(1995).Electronegativity Topologic Index - A New Method for Numerization of Structural Information.ACTA PHYSICO-CHIMICA SINICA,11(9),777-780.
MLA Zhou Jiaju,et al."Electronegativity Topologic Index - A New Method for Numerization of Structural Information".ACTA PHYSICO-CHIMICA SINICA 11.9(1995):777-780.
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