Nondestructive Differentiation of Panax Species Using Visible and Shortwave Near-Infrared Spectroscopy

Visible and short-wave near-infrared (Vis-SWNIR) spectroscopy was investigated to differentiate species of panax, including American Panax quinquefoliumI, Chinese Panax quinquefolium, and Chinese Panax ginseng. Principal component analysis (PCA) was applied before least-square support vector machine (LS-SVM) modeling, and the vast points of the spectral data (376–1,025 nm) were effectively reduced. PCA-LS-SVM differentiated species with 100% correct classification rate for the tested samples. In addition, effective wavelengths were selected according to modeling power, discrimination power, regression coefficients, loading weights, and genetic algorithms, respectively. The optimal and simplified LS-SVM model with 100% correct classification rate was achieved using the effective wavelengths selected by genetic algorithms. The results showed that Vis-SWNIR spectroscopy technique can be applied as a high accuracy and fast way for the qualitative discrimination of herb species.

[1]  D. Massart,et al.  Near-infrared spectroscopy applications in pharmaceutical analysis. , 2007, Talanta.

[2]  B. Kowalski Chemometrics : theory and application : a symposium , 1977 .

[3]  J. Reeves Effects of Water on the Spectra of Model Compounds in the Short-Wavelength near Infrared Spectral Region (14,000–9091 cm−1 or 714–1100 nm) , 1994 .

[4]  R. Shah,et al.  Least Squares Support Vector Machines , 2022 .

[5]  G. W. Small,et al.  Comparison of combination and first overtone spectral regions for near-infrared calibration models for glucose and other biomolecules in aqueous solutions. , 2004, Analytical chemistry.

[6]  M. Vanhaelen,et al.  High-performance thin-layer chromatographic determination of six major ginsenosides in Panax ginseng. , 2000, Journal of chromatography. A.

[7]  Johan A. K. Suykens,et al.  Multiclass least squares support vector machines , 1999, IJCNN'99. International Joint Conference on Neural Networks. Proceedings (Cat. No.99CH36339).

[8]  M. Otsuka,et al.  Comparative particle size determination of phenacetin bulk powder by using Kubelka–Munk theory and principal component regression analysis based on near-infrared spectroscopy , 2004 .

[9]  Yoram Singer,et al.  Reducing Multiclass to Binary: A Unifying Approach for Margin Classifiers , 2000, J. Mach. Learn. Res..

[10]  Qun Zhou,et al.  Differentiation of Asian ginseng, American ginseng and Notoginseng by Fourier transform infrared spectroscopy combined with two-dimensional correlation infrared spectroscopy , 2008 .

[11]  Zhide Hu,et al.  Structure-activity relationship study of oxindole-based inhibitors of cyclin-dependent kinases based on least-squares support vector machines. , 2007, Analytica chimica acta.

[12]  D. Cozzolino,et al.  Feasibility study on the use of visible and near-infrared spectroscopy together with chemometrics to discriminate between commercial white wines of different varietal origins. , 2003, Journal of agricultural and food chemistry.

[13]  D. Case,et al.  Characterization of domain-peptide interaction interface: a case study on the amphiphysin-1 SH3 domain. , 2008, Journal of molecular biology.

[14]  Di Wu,et al.  Study on infrared spectroscopy technique for fast measurement of protein content in milk powder based on LS-SVM , 2008 .

[15]  Angela Trocino,et al.  Prediction of chemical composition and origin identification of European sea bass (Dicentrarchus labrax L.) by near infrared reflectance spectroscopy (NIRS) , 2004 .

[16]  A Photodiode-Array-Based Near-Infrared Spectrophotometer for the 600–1100 nm Wavelength Region , 1989 .

[17]  A. Peirs,et al.  Nondestructive measurement of fruit and vegetable quality by means of NIR spectroscopy: A review , 2007 .

[18]  S. Bent,et al.  Commonly used herbal medicines in the United States: a review. , 2004, The American journal of medicine.

[19]  Angelo Fabbri,et al.  Non-destructive freshness assessment of shell eggs using FT-NIR spectroscopy , 2008 .

[20]  H. Heise,et al.  Multivariate calibration for protein, cholesterol and triglycerides in human plasma using short-wave near infrared spectrometry , 1995 .

[21]  E Nocerino,et al.  The aphrodisiac and adaptogenic properties of ginseng. , 2000, Fitoterapia.

[22]  C. Pizarro,et al.  Near Infrared Spectroscopy and Pattern Recognition Methods Applied to the Classification of Vinegar According to Raw Material and Elaboration Process , 2004 .

[23]  Yong He,et al.  Evaluation of Least Squares Support Vector Machine Regression and other Multivariate Calibrations in Determination of Internal Attributes of Tea Beverages , 2010 .

[24]  N. Fuzzati Analysis methods of ginsenosides. , 2004, Journal of chromatography. B, Analytical technologies in the biomedical and life sciences.

[25]  Young-Ah Woo,et al.  Near-infrared (NIR) spectroscopy for the non-destructive and fast determination of geographical origin of Angelicae gigantis Radix. , 2005, Journal of pharmaceutical and biomedical analysis.

[26]  Sabine Van Huffel,et al.  Brain tumor classification based on long echo proton MRS signals , 2004, Artif. Intell. Medicine.

[27]  Gerard Downey,et al.  Application of Near and Mid-Infrared Spectroscopy to Determine Cheese Quality and Authenticity , 2008 .

[28]  H. Mishra,et al.  FTNIR Spectroscopic Method for Determination of Moisture Content in Green Tea Granules , 2011 .

[29]  S. Wold,et al.  SIMCA: A Method for Analyzing Chemical Data in Terms of Similarity and Analogy , 1977 .

[30]  Yong He,et al.  Measurement of Soluble Solids Content and pH of Yogurt Using Visible/Near Infrared Spectroscopy and Chemometrics , 2009 .

[31]  R. V. van Breemen,et al.  Use of high-performance liquid chromatography-tandem mass spectrometry to distinguish Panax ginseng C. A. Meyer (Asian ginseng) and Panax quinquefolius L. (North American ginseng). , 2000, Analytical chemistry.

[32]  David D. Kitts,et al.  Free radical scavenging capacity as related to antioxidant activity and ginsenoside composition of Asian and North American ginseng extracts , 2001 .

[33]  Y. Roggo,et al.  A review of near infrared spectroscopy and chemometrics in pharmaceutical technologies. , 2007, Journal of pharmaceutical and biomedical analysis.

[34]  J. Roger,et al.  Application of LS-SVM to non-linear phenomena in NIR spectroscopy: development of a robust and portable sensor for acidity prediction in grapes , 2004 .

[35]  Di Wu,et al.  Short-wave near-infrared spectroscopy analysis of major compounds in milk powder and wavelength assignment. , 2008, Analytica chimica acta.

[36]  Quansheng Chen,et al.  Qualitative Identification of Tea by near Infrared Spectroscopy Based on Soft Independent Modelling of Class Analogy Pattern Recognition , 2005 .