Spectroscopy and Spectral Analysis, Volume. 35, Issue 10, 2730(2015)

Study on the Application of NAS-Based Algorithm in the NIR Model Optimization

GENG Ying1、*, XIANG Bing-ren2, and HE Lan1
Author Affiliations
  • 1[in Chinese]
  • 2[in Chinese]
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    In this paper, net analysis signal (NAS)-based concept was introduced to the analysis of multi-component Ginkgo biloba leaf extracts. NAS algorithm was utilized for the preprocessing of spectra, and NAS-based two-dimensional correlation analysis was used for the optimization of NIR model building. Simultaneous quantitative models for three flavonol aglycones: quercetin, keampferol and isorhamnetin were established respectively. The NAS vectors calculated using two algorithms introduced from Lorber and Goicoechea and Olivieri (HLA/GO) were applied in the development of calibration models, the reconstructed spectra were used as input of PLS modeling. For the first time, NAS-based two-dimensional correlation spectroscopy was used for wave number selection. The regions appeared in the main diagonal were selected as useful regions for model building. The results implied that two NAS-based preprocessing methods were successfully used for the analysis of quercetin, keampferol and isorhamnetin with a decrease of factor number and an improvement of model robustness. NAS-based algorithm was proven to be a useful tool for the preprocessing of spectra and for optimization of model calibration. The above research showed a practical application value for the NIRS in the analysis of complex multi-component petrochemical medicine with unknown interference.

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    GENG Ying, XIANG Bing-ren, HE Lan. Study on the Application of NAS-Based Algorithm in the NIR Model Optimization[J]. Spectroscopy and Spectral Analysis, 2015, 35(10): 2730

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    Paper Information

    Received: Jun. 27, 2014

    Accepted: --

    Published Online: Feb. 2, 2016

    The Author Email: Ying GENG (gy-vera@163.com)

    DOI:10.3964/j.issn.1000-0593(2015)10-2730-04

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