The Quality Assessment of Cigarette Paper by SIMCA and PLS Combined with Near Infrared Spectrum
WANG Jia-jun1,WANG Fan2,MA Ling1
1. Production Research Center, Honghe Cigarette General Factory, Mile 652300, China 2. Department of Chemistry, Qujing Teacher’s College, Qujing 655000, China
Abstract：By using algorithm of SIMCA and partial least squares(PLS) combined with Fourier transform near infrared spectra(FT-NIR), the classification methods were established for the discrimination of cigarette paper. Meanwhile, the calibration models were established for the determination of the grammage, thickness, permeability, moisture and ash of cigarette paper. Correlation coefficients of the models were 0.976 8, 0.966 4, 0.947 0, 0.956 3 and 0.975 9, and the root mean square errors of cross validation (RMSECV) were 0.561 4, 0.096 0, 1.274 1, 0.096 7 and 0.260 3 respectively. The methods has been applied to the determination and discrimination of unknown samples with satisfactory results.
王家俊1,汪帆2,马玲1 . SIMCA分类法与PLS算法结合近红外光谱应用于卷烟纸的质量控制[J]. 光谱学与光谱分析, 2006, 26(10): 1858-1862.
WANG Jia-jun1,WANG Fan2,MA Ling1 . The Quality Assessment of Cigarette Paper by SIMCA and PLS Combined with Near Infrared Spectrum . SPECTROSCOPY AND SPECTRAL ANALYSIS, 2006, 26(10): 1858-1862.
[1] HU Qun，MA Jing，XIAO Yan, et al(胡 群，马 静，肖 燕, 等编译). Study of Auxiliary Material for Cigarette(卷烟辅料研究). Kunming：Yunnan Science and Technology Press(昆明：云南科技出版社)，2001. 25. [2] Jerome J，Workman Jr. Applied Spectroscopy Reviews，1999，34(1&2): 1. [3] XU Guang-tong，YUAN Hong-fu, LU Wan-zhen(徐广通，袁洪福，陆婉珍). Spectroscopy and Spectral Analysis(光谱学与光谱分析)，2000，20(2)：134. [4] WANG Jia-jun(王家俊). Chinese Journal of Spectroscopy Laboratory(光谱实验室)，2003，20(2) ：181. [5] WANG Jia-jun，LUO Li-ping，LI Hui, et al(王家俊，罗丽萍，李 辉, 等). Tobacco Science & Technology(烟草科技)，2004，(12)：24. [6] WANG Jia-jun，LIANG Yi-zeng，WANG Fan(王家俊，梁逸曾，汪 帆). Chinese J. Anal. Chem.(分析化学)，2005，33(6) ：793. [7] WANG Jia-jun，LIANG Yi-zeng，WANG Fan(王家俊，梁逸曾，汪 帆). Computers and Applied Chemistry(计算机与应用化学)，In press. [8] Wold S. Pattern Recognition，1976，9：127. [9] LIANG Yi-zeng(梁逸曾). White, Grey and Black Multicomponent System and Their Chemometric Algorithms(白灰黑复杂多组分分析体系及其化学计量学算法). Changsha：Hunan Publishing House of Science and Technology(长沙：湖南科技出版社)，1996. 32. [10] Edited by Infometrix Inc. Multivariate Data Analysis, Woodinville：Infometrix Inc.，2003. 6, 14. [11] SHI Wei-wei, GAN Wu-er, SU Qing-de(石玮玮，淦五二，苏庆德). Spectroscopy and Spectral Analysis(光谱学与光谱分析)，2005，25(7)：1135.
