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Determination of Pear Internal Quality Attributes by Fourier Transform Near Infrared (FT-NIR) Spectroscopy and Multivariate Analysis

机译:傅立叶变换近红外(FT-NIR)光谱和多元分析确定梨的内部质量属性

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摘要

This paper attempted the feasibility to determine firmness and soluble solid content (SSC) in intact pears using Fourier transform near infrared (FT-NIR) spectroscopy coupled with multivariate analysis. Principal component analysis and independent component analysis were employed comparatively to extract latent vectors from the original spectra data. Extreme learning machine (ELM) was performed to calibrate regression model. Some parameters of ELM model were optimized according to the lowest root mean square error of cross-validation in the calibration set. Moreover, the root mean square error of prediction of the calibration model was finally corrected for making it more closed to the true prediction error due to the effect of reference measurementerror existing in the pear sample attribute value on the prediction error of the model. Experimental results showed that the R2p and ratio performance deviation (RPD) in the prediction set were achieved as follows: R2p =0.81 and RPD=2.28 for the firmness model when ICs=6 and R2p =0.91 and RPD=3.43 for the SSC model when ICs=5. This study demonstrates that the predictive precision of the calibration model can be effectively enhanced in measurement of firmness and SSC in intact pears by use of FT-NIR spectroscopy combined with appropriate chemometrics methods.
机译:本文尝试使用傅立叶变换近红外光谱(FT-NIR)和多变量分析来确定完整梨中的硬度和可溶性固形物含量(SSC)的可行性。比较地采用主成分分析和独立成分分析从原始光谱数据中提取潜在矢量。执行极限学习机(ELM)来校准回归模型。根据校准集中交叉验证的最低均方根误差,对ELM模型的某些参数进行了优化。此外,由于存在于梨样本属性值中的参考测量误差对模型的预测误差的影响,最终校正了校准模型的预测的均方根误差,以使其更接近真实的预测误差。实验结果表明,预测集中的R2p和比率性能偏差(RPD)达到如下:当ICs = 6且R2p = 0.91且SSC模型当RPD = 3.43时,硬度模型的R2p = 0.81和RPD = 2.28。 IC = 5。这项研究表明,通过使用FT-NIR光谱结合适当的化学计量学方法,可以在完整梨的硬度和SSC测量中有效地提高校准模型的预测精度。

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