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銀杏葉總黃酮含量近紅外光譜檢測的特征譜區(qū)篩選
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國家高技術(shù)研究發(fā)展計劃(863計劃)資助項目(2008AA10Z208);國家自然科學(xué)基金資助項目(60901079);全國優(yōu)秀博士基金資助項目(200968);江蘇省農(nóng)業(yè)自主創(chuàng)新計劃資助項目(CX(11)2028);江蘇大學(xué)拔尖人才啟動基金資助項目


Selection of Wavelength Regions to Determine Flavonoids Content in Ginkgo Leaves by FT—NIR Spectroscopy
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    摘要:

    通過區(qū)間偏最小二乘法(iPLS)譜區(qū)篩選方法、反向區(qū)間偏最小二乘法(biPLS)譜區(qū)篩選方法和聯(lián)合區(qū)間偏最小二乘法(siPLS)譜區(qū)篩選方法優(yōu)化光譜特征區(qū)間,,建立黃酮含量分析模型,,并與波數(shù)范圍為4000~8000cm-1的全光譜偏最小二乘(PLS)模型進(jìn)行比較,。結(jié)果表明,,采用siPLS譜區(qū)篩選方法將全光譜均勻劃分21個子區(qū)間,,選擇兩個子區(qū)間(7,、12區(qū)間)聯(lián)合時,,建立的siPLS譜區(qū)篩選模型預(yù)測效果最佳,,其交互驗證均方根誤差和預(yù)測均方根誤差分別為2.9500和3.000,校正集和預(yù)測集相關(guān)系數(shù)分別為0.9384和0.9437,。因此采用siPLS譜區(qū)篩選方法可以有效選擇光譜特征區(qū)域,,提高建模預(yù)測能力,實現(xiàn)銀杏葉總黃酮含量的快速檢測,。

    Abstract:

    In order to improve the detecting accuracy rating and stability of total flavonoids content in ginkgo leaves by near infrared spectroscopy technique, a precision model was established by selecting efficient spectral regions combined with different partial least squares (PLS) selecting wavelength regions methods. Three improved partial least squares (PLS) methods, including interval partial least squares (iPLS) selecting wavelength regions method, backward interval partial least squares (biPLS) selecting wavelength regions method and synergy interval partial least squares (siPLS) selecting wavelength regions method were used to find the most informative ranges and build models with better predictive flavonoids content in ginkgo leaves at first. And then the models were compared with PLS model which was developed on the whole wavelength range 4000~8000cm-1. Results showed that the models built by the three improved PLS methods had higher predictive ability than that of PLS method. The optimal model was the one that obtained by siPLS selecting wavelength regions method and it separated the whole spectra into 21 intervals and combined two intervals including interval 7 and interval 12, the RMSECV and RMSEP were 2.9500 and 3.000, calibration and the prediction correlation coefficient were 0.9384 and 0.9437. The conclusion is siPLS method can accurately and rapidly predict flavonoids content in ginkgo leaves.

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鄒小波,黃曉瑋,石吉勇,陳正偉,張德濤.銀杏葉總黃酮含量近紅外光譜檢測的特征譜區(qū)篩選[J].農(nóng)業(yè)機(jī)械學(xué)報,2012,43(9):155-159. Zou Xiaobo, Huang Xiaowei, Shi Jiyong, Chen Zhengwei, Zhang Detao. Selection of Wavelength Regions to Determine Flavonoids Content in Ginkgo Leaves by FT—NIR Spectroscopy[J]. Transactions of the Chinese Society for Agricultural Machinery,2012,43(9):155-159.

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  • 在線發(fā)布日期: 2012-09-04
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