Variable selection in multivariate calibration of a spectroscopic glucose sensor

被引:39
作者
McShane, MJ
Cote, GL
Spiegelman, C
机构
[1] TEXAS A&M UNIV,BIOMED ENGN PROGRAM,COLLEGE STN,TX 77843
[2] TEXAS A&M UNIV,DEPT STAT,COLLEGE STN,TX 77843
关键词
near-infrared spectroscopy; multivariate calibration; variable selection; glucose; sensors;
D O I
10.1366/0003702971939118
中图分类号
TH7 [仪器、仪表];
学科分类号
0804 ; 080401 ; 081102 ;
摘要
A variable selection method that reduces prediction bias in partial least-squares regression models was developed and applied to near-infrared absorbance spectra of glucose in pH buffer and cell culture medium. Comparisons between calibration and prediction capability for full spectra and reduced sets were completed. Variable selection resulted in statistically equivalent errors while reducing the number of wavelengths needed to fit the calibration data and predict concentrations from new spectra. Fewer than 25 wavelengths were selected to produce errors statistically equivalent to those yielded by the full set containing over 500 wavelengths. The algorithm correctly chose the glucose absorption peak areas as the information-carrying spectral regions.
引用
收藏
页码:1559 / 1564
页数:6
相关论文
共 25 条
[1]   Genetic algorithm-based method for selecting wavelengths and model size for use with partial least-squares regression: Application to near-infrared spectroscopy [J].
Bangalore, AS ;
Shaffer, RE ;
Small, GW ;
Arnold, MA .
ANALYTICAL CHEMISTRY, 1996, 68 (23) :4200-4212
[2]   MATRIX REPRESENTATIONS AND CRITERIA FOR SELECTING ANALYTICAL WAVELENGTHS FOR MULTICOMPONENT SPECTROSCOPIC ANALYSIS [J].
BROWN, CW ;
LYNCH, PF ;
OBREMSKI, RJ ;
LAVERY, DS .
ANALYTICAL CHEMISTRY, 1982, 54 (09) :1472-1479
[3]   CHEMOMETRICS AND SPECTRAL FREQUENCY SELECTION [J].
BROWN, PJ ;
SPIEGELMAN, CH ;
DENHAM, MC .
PHILOSOPHICAL TRANSACTIONS OF THE ROYAL SOCIETY OF LONDON SERIES A-MATHEMATICAL PHYSICAL AND ENGINEERING SCIENCES, 1991, 337 (1647) :311-322
[4]   WAVELENGTH SELECTION IN MULTICOMPONENT NEAR-INFRARED CALIBRATION [J].
BROWN, PJ .
JOURNAL OF CHEMOMETRICS, 1992, 6 (03) :151-161
[6]   Simultaneous measurements of glucose, glutamine, ammonia, lactate, and glutamate in aqueous solutions by near-infrared spectroscopy [J].
Chung, H ;
Arnold, MA ;
Rhiel, M ;
Murhammer, DW .
APPLIED SPECTROSCOPY, 1996, 50 (02) :270-276
[7]   NONINVASIVE OPTICAL POLARIMETRIC GLUCOSE SENSING USING A TRUE PHASE MEASUREMENT TECHNIQUE [J].
COTE, GL ;
FOX, MD ;
NORTHROP, RB .
IEEE TRANSACTIONS ON BIOMEDICAL ENGINEERING, 1992, 39 (07) :752-756
[8]   APPLICATION OF A MULTIVARIATE TECHNIQUE TO RAMAN-SPECTRA FOR QUANTIFICATION OF BODY CHEMICALS [J].
GOETZ, MJ ;
COTE, GL ;
ERCKENS, R ;
MARCH, W ;
MOTAMEDI, M .
IEEE TRANSACTIONS ON BIOMEDICAL ENGINEERING, 1995, 42 (07) :728-731
[9]  
GOETZ MJ, 1995, 226 TEX A M U DEP ST
[10]   TEMPERATURE-INSENSITIVE NEAR-INFRARED SPECTROSCOPIC MEASUREMENT OF GLUCOSE IN AQUEOUS-SOLUTIONS [J].
HAZEN, KH ;
ARNOLD, MA ;
SMALL, GW .
APPLIED SPECTROSCOPY, 1994, 48 (04) :477-483