title: Detection of glutamic acid in oilseed rape leaves using near infrared spectroscopy and the least squares-support vector machine.
abstract: Amino acids are quite important indices to indicate the growth status of  oilseed rape under herbicide stress. Near infrared (NIR) spectroscopy combined with chemometrics was applied for fast determination of glutamic acid in oilseed rape leaves. The optimal spectral preprocessing method was obtained after comparing Savitzky-Golay smoothing, standard normal variate, multiplicative scatter correction, first and second derivatives, detrending and direct orthogonal signal correction. Linear and nonlinear calibration methods were developed, including partial least squares (PLS) and least squares-support vector machine (LS-SVM). The most effective wavelengths (EWs) were determined by the successive projections algorithm (SPA), and these wavelengths were used as the inputs of PLS and LS-SVM model. The best prediction results were achieved by SPA-LS-SVM (Raw) model with correlation coefficient r = 0.9943 and root mean squares error of prediction (RMSEP) = 0.0569 for prediction set. These results indicated that NIR spectroscopy combined with SPA-LS-SVM was feasible for the fast and effective detection of glutamic acid in oilseed rape leaves. The selected EWs could be used to develop spectral sensors, and the important and basic amino acid data were helpful to study the function mechanism of herbicide.
authors.affiliation: College of Biosystems Engineering and Food Science, Zhejiang University, Hangzhou 310058, China. fliu@zju.edu.cn.
authors.forename: Yidan
authors.initials: Y
authors.lastname: Bao
authors.forename: Wenwen
authors.initials: W
authors.lastname: Kong
authors.forename: Fei
authors.initials: F
authors.lastname: Liu
authors.forename: Zhengjun
authors.initials: Z
authors.lastname: Qiu
authors.forename: Yong
authors.initials: Y
authors.lastname: He
mesh_terms: D029741:Brassica rapa / Q000737:chemistry*; D018698:Glutamic Acid / Q000737:chemistry*; D006540:Herbicides / Q000737:chemistry; D016018:Least-Squares Analysis; D018515:Plant Leaves / Q000737:chemistry*; D019265:Spectroscopy, Near-Infrared; D060388:Support Vector Machine
chemical_list: D006540:Herbicides; D018698:Glutamic Acid