基于变量选择的小麦粗蛋白含量近红外光谱检测
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国家国际科技合作专项(2014DFA31660)


Variable Selection Based Near Infrared Spectroscopic Quantitative Analysis on Wheat Crude Protein Content
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    摘要:

    小麦粗蛋白含量是其品质评价的重要指标,为探讨基于选择的短波近红外光谱变量定量判别小麦籽粒粗蛋白的可能性,采集了52份小麦籽粒样本,用湿化学方法分析其粗蛋白含量,获取其900~1700nm波段的光谱,进而利用该光谱进行预处理方法的优化研究及小麦籽粒蛋白敏感变量的优选研究,以偏最小二乘的方法建立了基于短波近红外光谱的小麦籽粒蛋白定量模型。结果表明:多元散射校正和小波变换结合是短波近红外光谱定量判别小麦籽粒粗蛋白含量较优的预处理方法;利用200次竞争性自适应重加权变量优选的统计结果,优选出1028、1158、1199、1367、1407、1445、1478、1494、1550、1584、1661、1686nm 12个变量为小麦籽粒蛋白敏感变量,占全谱的2%,该方法可稳定、高效地优选光谱变量,降低水分对模型的影响;结合预处理优化及变量优选建立偏最小二乘模型,模型预测决定系数和预测均方差分别为0.961和0.369。可见优选的短波近红外光谱变量可用于定量判别小麦籽粒粗蛋白含量。

    Abstract:

    Wheat is one of the main cereal grain which was produced not only in China but also at abroad. The aim of this paper is to study the feasibility of several selected variables from short wavelength near infrared spectroscopy to quantify crude protein of the whole wheat grain. In total, 52 whole wheat grain samples were collected, including 39 samples for calibration and 13 samples for validation. On the one hand, the crude protein of these samples were analyzed by using the Chinese standard of Kjeldahl method; on the other hand, those were scanned to obtain near infrared spectra with the wavelength range of 900~1700nm by using a wheat analysis system developed by Chinese Academy of Agricultural Mechanization Sciences (CAAMS). Both of spectroscopic pretreatment method and sensitive variables were optimized, then the model was built by partial least squares regression method. The results showed the combination of multiple scattering correction and wavelet transform performed better. Competitive adaptive reweighted sampling method showed an efficient variable selection, which picking 12 variables and taking 2% of the full range spectral variables, including 1028, 1158, 1199, 1367, 1407, 1445, 1478, 1494, 1550, 1584, 1661, 1686nm. Based on the optimized pretreatment method and selected variables, the model showed that the prediction determination coefficient and prediction root mean square error were 0.961 and 0.369, respectively. Competitive adaptive reweighted sampling variable selection based short wavelength near infrared spectroscopic technique showed a potential for crude protein quantitative analysis on whole wheat grain.

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吕程序,姜训鹏,张银桥,张小超,毛文华.基于变量选择的小麦粗蛋白含量近红外光谱检测[J].农业机械学报,2016,47(s1):340-346.

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  • 收稿日期:2016-07-20
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  • 在线发布日期: 2016-10-15
  • 出版日期: 2016-10-15