Electronegativity Topologic Index - A New Method for Numerization of Structural Information
文献类型:期刊论文
作者 | Zhou Jiaju; Xie Guirong; Xie Qian; Sun Hongmei; Feng Jun; Xu Zhihong |
刊名 | ACTA PHYSICO-CHIMICA SINICA
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出版日期 | 1995 |
卷号 | 11期号:9页码:777-780 |
关键词 | Numerization of structural information ETI ANN QSAR |
ISSN号 | 1000-6818 |
其他题名 | Acta Phys.-Chim. Sin. |
中文摘要 | 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. |
英文摘要 | 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. |
WOS标题词 | Science & Technology ; Physical Sciences |
类目[WOS] | Chemistry, Physical |
研究领域[WOS] | Chemistry |
收录类别 | SCI |
原文出处 | |
语种 | 英语 |
WOS记录号 | WOS:000207590800003 |
公开日期 | 2013-11-15 |
版本 | 出版稿 |
源URL | [http://ir.ipe.ac.cn/handle/122111/5912] ![]() |
专题 | 过程工程研究所_研究所(批量导入) |
作者单位 | Chinese Acad Sci, Lab Comp Chem, Inst Chem Met, Beijing 100080, Peoples R China |
推荐引用方式 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. |
入库方式: OAI收割
来源:过程工程研究所
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