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首页> 外文期刊>Journal of near infrared spectroscopy >Transfer of a calibration model for the prediction of lignin in pulpwood among four portable near infrared spectrometers
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Transfer of a calibration model for the prediction of lignin in pulpwood among four portable near infrared spectrometers

机译:4台便携式近红外光谱仪中木质素预测的标定模型

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摘要

In order to reduce the time and cost for near infrared (NIR) model development and maintenance, the transfer of NIR spectra measured on four different portable spectrometers (one master and three target instruments) for predicting the lignin content of pulp wood is investigated in this work. Eighty-two wood samples were prepared by chipping and grinding, and their NIR spectra were recorded with four spectrometers. Calibration models for the determination of lignin in pulp wood have been developed by partial least squares (PLS) regression, while average Mahalanobis distances (AMD) and average differences of spectra (ADS) were used to quantify the spectral differences. Then piecewise direct standardization (PDS) has been applied, and compared to direct standardization (DS), slope/bias correction (SBC) and canonical correlation analysis (CCA). The accuracy of the models has been evaluated by comparing their prediction performance. The results indicated that the prediction performances of the three target instruments are greatly improved by using the three algorithms. The advantage of the PDS algorithm is that fewer samples are required for the transfer sets, which means lower model maintenance cost for practical applications. When it comes to window size setting procedure, it was found that if there are large spectral differences between the master and the target spectrometer, a large window size should be used and if the spectral difference is a significant lateral shift, an asymmetric window with appropriate window size is necessary to ensure a good transfer performance for the PDS algorithm.
机译:为了减少近红外(NIR)模型开发和维护的时间和成本,本文研究了在四种不同的便携式光谱仪(一台主仪器和三台目标仪器)上测量的近红外光谱的转移,以预测纸浆木材的木质素含量。通过削片和研磨制备了82个木材样品,并用4个光谱仪记录了它们的近红外光谱。采用偏最小二乘法(PLS)回归建立了纸浆木材中木质素测定的校准模型,同时采用平均马氏距离(AMD)和光谱平均差(ADS)对光谱差异进行量化。然后应用分段直接标准化(PDS),并与直接标准化(DS)、斜率/偏差校正(SBC)和典型相关分析(CCA)进行比较。通过比较模型的预测性能来评估模型的准确性。结果表明,使用3种算法大大提高了3种目标工具的预测性能。PDS算法的优点是转移集需要的样本更少,这意味着实际应用的模型维护成本更低。在窗口尺寸设置程序方面,发现如果主光谱仪和目标光谱仪之间存在较大的光谱差异,则应使用较大的窗口尺寸,如果光谱差异是显着的横向偏移,则需要具有适当窗口尺寸的不对称窗口,以确保PDS算法具有良好的传输性能。

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