Research on the quantitative analysis of near infrared spectroscopy of astragaloside based on artificial neural network and wavelet transform

Zhang Yong, Y. Hua
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Abstract

With rapidly analysis, no pollution, no damage, simple operation, low analysis cost, environmental protection and many other advantages, the near infrared spectroscopy (NIR) analysis has made breakthrough progress in the Chinese medicine field. In this paper, the near infrared spectrometry of extract of two kinds of astragalus is determined. Wavelet transform is used to compress the spectral variables, and the quantitative analysis models are carried on using artificial neural network technology in order to analyze the astragaloside content of extract of two kinds of astragalus. The simulation results show that, the prediction decision coefficient(R2) is 0.9863, the average relative error is 0.0354, the root mean square error of Cross-Validation(RMSECV) is 0.0258 in the astragalus extract samples (the ratio of material to liquid 1:2), and the predictive decision coefficient is 0.9798, the average relative error is 0.0425, and the root mean square error of Cross-Validation is 0.0301 in the astragalus extract samples (the ratio of material to liquid 1:5). The evaluation model can meet the need of practical application, and provide technical support for quantitative analysis to extract of astragalus and analysis of near infrared spectroscopy in traditional Chinese medicinal materials.
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基于人工神经网络和小波变换的黄芪甲苷近红外光谱定量分析研究
近红外光谱(NIR)分析具有分析快速、无污染、无损伤、操作简单、分析成本低、环保等诸多优点,在中药领域取得了突破性进展。本文对两种黄芪提取物的近红外光谱进行了测定。利用小波变换对光谱变量进行压缩,并利用人工神经网络技术建立定量分析模型,对两种黄芪提取物中黄芪甲苷含量进行分析。仿真结果表明,黄芪提取液样品(料液比1:2)的预测决策系数(R2)为0.9863,平均相对误差为0.0354,交叉验证的均方根误差(RMSECV)为0.0258;黄芪提取液样品(料液比1:5)的预测决策系数为0.9798,平均相对误差为0.0425,交叉验证的均方根误差为0.0301。该评价模型能够满足实际应用的需要,为黄芪提取物的定量分析和中药材近红外光谱分析提供技术支持。
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