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    傅里叶变换红外光谱指纹图谱鉴别艾绒等级

    Identification of Moxa Grade by Fourier Transform Infrared Spectroscopy Fingerprint

    • 摘要: 提出了傅里叶变换红外光谱指纹图谱鉴别艾绒等级的方法,通过8种光谱预处理方法(去噪处理、高斯滤波、多元散射校正、标准正态变换、一阶导数+Savitzky-Golay(SG)平滑、二阶导数+SG平滑、一阶导数+Norris Gap、二阶导数+Norris Gap)和5种模式识别方法反向传播神经网络(BP-NN)算法、遗传优化支持向量机(SVM-ga)、粒子群优化支持向量机(SVM-pso)、随机森林(RF)算法、K-最近邻(KNN)算法的结合对比,得到鉴别艾绒等级的最佳模型。结果表明,艾绒的指纹图谱中有11个共有峰,对其进行主成分分析,得到9个主成分,累计方差贡献率达到99.67%。标准正态变换结合SVM-pso算法的鉴别效果最好,其训练集的鉴别正确率为100%,测试集的鉴别正确率为93.3%。

       

      Abstract: A method for identification of moxa grade by Fourier transform infrared spectroscopy fingerprint was proposed, and the optimal model for identifying moxa grade was obtained by comparison of combination of 8 spectral preprocessing methods denoising, Gaussian filtering, multivariate scattering correction, standard normal transformation, first derivative + Savitzky- Golay (SG) smoothing, second derivative + SG smoothing, first derivative + Norris Gap, and second derivative + Norris Gap and 5 pattern recognition methods back propagation neural network (BP-NN) algorithm, genetic optimization support vector machine (SVM-ga), particle swarm optimization support vector machine (SVM-pso), random forest (RF) algorithm, and K-nearest neighbor (KNN) algorithm. As shown by the results, there were 11 common peaks in maxo fingerprint. Nine principal components were obtained by principal component analysis, and the cumulative variance contribution rate reached 99.67%. The combination of standard normal transformation and SVM-pso algorithm had the best discrimination effect, with the discrimination accuracy of 100% in the training set and 93.3% in the test set.

       

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