Calibration transfer of near‐infrared spectra for extraction of informative components from spectra with canonical correlation analysis
作者： Kaiyi Zheng , Xuan Zhang , Jibran Iqbal , Wei Fan , Ting Wu
DOI: 10.1002/CEM.2637
关键词: Mathematics 、 Spectral line 、 Canonical correlation 、 Piecewise 、 Extraction (chemistry) 、 Partial least squares regression 、 Biological system 、 Statistics 、 Interference (wave propagation) 、 Calibration (statistics) 、 Noise (signal processing)
摘要: A new calibration transfer method that applies canonical correlation analysis (CCA) to the informative components extracted from a spectral dataset is proposed reduce interference of noise, background and non-predicted properties. This employs partial least squares extract related predicted properties raw spectra then corrects based on CCA. The performance this algorithm was tested using three pairs batches: two corn one pair tri-component solvent spectra. results showed can significantly prediction errors compared with CCA piecewise direct standardization. Copyright © 2014 John Wiley & Sons, Ltd.
sci-hub.se 参考文章(32)
Herman Wold, Causal flows with latent variables European Economic Review. ,vol. 5, pp. 67- 86 ,(1974) , 10.1016/0014-2921(74)90008-7
Richard Noonan, NIPALS Path Modelling with Latent Variables Scandinavian Journal of Educational Research. ,vol. 21, pp. 33- 61 ,(1977) , 10.1080/0031383770210103
John B. Cooper, Christopher M. Larkin, Mohamed F. Abdelkader, Calibration transfer of near‐IR partial least squares property models of fuels using virtual standards Journal of Chemometrics. ,vol. 25, pp. 496- 505 ,(2011) , 10.1002/CEM.1395
Eva-Lotta Bergman, Henric Brage, Mats Josefson, Olof Svensson, Anders Sparén, Transfer of NIR calibrations for pharmaceutical formulations between different instruments. Journal of Pharmaceutical and Biomedical Analysis. ,vol. 41, pp. 89- 98 ,(2006) , 10.1016/J.JPBA.2005.10.042
Wei Fan, Yizeng Liang, Dalin Yuan, Jiajun Wang, Calibration model transfer for near-infrared spectra based on canonical correlation analysis. Analytica Chimica Acta. ,vol. 623, pp. 22- 29 ,(2008) , 10.1016/J.ACA.2008.05.072
Matthew R Kunz, Joshua Ottaway, John H Kalivas, Erik Andries, None, Impact of standardization sample design on Tikhonov regularization variants for spectroscopic calibration maintenance and transfer Journal of Chemometrics. ,vol. 24, pp. 218- 229 ,(2010) , 10.1002/CEM.1302
Ola Friman, Jonny Cedefamn, Peter Lundberg, Magnus Borga, Hans Knutsson, Detection of neural activity in functional MRI using canonical correlation analysis Magnetic Resonance in Medicine. ,vol. 45, pp. 323- 330 ,(2001) , 10.1002/1522-2594(200102)45:2<323::AID-MRM1041>3.0.CO;2-#
W. Wu, B. Walczak, D.L. Massart, S. Heuerding, F. Erni, I.R. Last, K.A. Prebble, Artificial neural networks in classification of NIR spectral data: Design of the training set Chemometrics and Intelligent Laboratory Systems. ,vol. 33, pp. 35- 46 ,(1996) , 10.1016/0169-7439(95)00077-1
Yongdong. Wang, Bruce R. Kowalski, Temperature-compensating calibration transfer for near-infrared filter instruments Analytical Chemistry. ,vol. 65, pp. 1301- 1303 ,(1993) , 10.1021/AC00057A031
Mathieu Boiret, Loïc Meunier, Yves-Michel Ginot, Tablet potency of Tianeptine in coated tablets by near infrared spectroscopy: model optimisation, calibration transfer and confidence intervals. Journal of Pharmaceutical and Biomedical Analysis. ,vol. 54, pp. 510- 516 ,(2011) , 10.1016/J.JPBA.2010.09.029