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红外谱图中特征峰与对应子结构相互关系的确定
Alternative TitleEstablishment of correspondence between characteristic peak and its substructure in IR spectra
陈海峰; 罗时玮; 姚建华; 袁身刚; 郑崇直; 范波涛; A. Panaye; J. P. Doucet
2000-01-01
Source Publication计算机与应用化学
ISSN1001-4160
Volume17Issue:2Pages:183-184
Abstract采用子结构检索、公共子结构寻找和相似指数计算的方法研究了红外特征吩与应子结构的相互关系。 说明对大量谱图信息进行统计分析确定基团的特征峰, 是一种行之有效的方法。
Other AbstractThis paper introduces a method which determinate the characteristic peak of IR through substructre searching, common substructure spreading, similarrity index calculating. It is effective and useful method to determinate characteristic peak of IR by statistic large spectrum information .
Subject Area计算机化学与化学信息学
Department中国科学院上海有机化学研究所计算机化学与化学信息研究室
Language中文
Document Type期刊论文
Identifierhttp://ir.sioc.ac.cn/handle/331003/20553
Collection计算机化学与化学信息学研究室
Recommended Citation
GB/T 7714
陈海峰,罗时玮,姚建华,等. 红外谱图中特征峰与对应子结构相互关系的确定[J]. 计算机与应用化学,2000,17(2):183-184.
APA 陈海峰.,罗时玮.,姚建华.,袁身刚.,郑崇直.,...&J. P. Doucet.(2000).红外谱图中特征峰与对应子结构相互关系的确定.计算机与应用化学,17(2),183-184.
MLA 陈海峰,et al."红外谱图中特征峰与对应子结构相互关系的确定".计算机与应用化学 17.2(2000):183-184.
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