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中药威灵仙的化学模式识别研究
引用本文:曾映旭,赵晨曦,梁逸曾,方洪壮,李晓宁.中药威灵仙的化学模式识别研究[J].计算机与应用化学,2006,23(9):825-828.
作者姓名:曾映旭  赵晨曦  梁逸曾  方洪壮  李晓宁
作者单位:1. 中南大学化学化工学院中药现代化研究所,湖南,长沙,410083
2. 中南大学化学化工学院中药现代化研究所,湖南,长沙,410083;长沙大学应用化学与环境科学系,湖南,长沙,410003
3. 佳木斯大学药学系,黑龙江,佳木斯,154007
摘    要:采用气相-质谱联用仪(GC-MS)对24个来源不同的威灵仙样品中的挥发油进行指纹图谱分析,并运用主成分分析法及K-均值聚类法对其进行化学模式识别研究。结果表明,所研究的24个威灵仙样品可分为两类,其中19个威灵仙药材样品化学成分相近,聚为一类,另外5个威灵仙药材化学成分与主体威灵仙药材成分有一定差异,被聚为另一类,这为威灵仙的质量控制提供了理论依据。本文所建立的主体威灵仙药材的指纹图谱化学模式可作为中药威灵仙的质量评价标准。

关 键 词:威灵仙  指纹图谱  化学模式识别  主成分分析法  K-均值聚类法
文章编号:1001-4160(2006)09-825-828
收稿时间:2006-01-21
修稿时间:2006-01-212006-03-28

Study on chemical pattern recognition of Clematis Chinensis Osbeck
Zeng Yingxu,Zhao Chenxi,Liang Yizeng,Fang Hongzhuang,Li Xiaoning.Study on chemical pattern recognition of Clematis Chinensis Osbeck[J].Computers and Applied Chemistry,2006,23(9):825-828.
Authors:Zeng Yingxu  Zhao Chenxi  Liang Yizeng  Fang Hongzhuang  Li Xiaoning
Affiliation:Research Center of Modernization of Chinese Herbal Medicine, College of Chemistryand Chemical Engineering, Central South University, Changsha 410083, Hunan, China
Abstract:The major compounds in the essential oils from Clematis Chinensis Osbeek.were identified by GC-MS and the fingerprints of the 24 samples were obtained and studied.A chemical pattern recognition method was constructed by using Principal Component Analy- sis(PCA)and K-means Clustering Method.The result shows,all the 24 samples studied could be divided into two categories.19 of the samples were clustered in one category,while the others,which had some differences in chemical compounds,were clustered in an- other category.The chemical pattern recognition of Clematis Chinensis Osbeck.established in this paper can be used to the quality evalu- ation of Clematis Chinensis Osbeck.
Keywords:Clematis Chinensis Osbeck  fingerprint  chemical pattern recognition  principal component analysis(PCA)  K-means clustering method
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