A particle swarm optimization(PSO)-based least square support vector machine(LS-SVM)method was investigated for quantitative analysis of extraction solution of Y angxinshi tablet using near infrared(NIR)spectroscopy.T...A particle swarm optimization(PSO)-based least square support vector machine(LS-SVM)method was investigated for quantitative analysis of extraction solution of Y angxinshi tablet using near infrared(NIR)spectroscopy.The usable spectral region(5400-6200cm^(-1))was identified,then the first derivative spectra smoothed using a Savitzky-Golay filter were employed to establish calibration models.The PSO algorithm was applied to select the LS-SVM hyper-parameters(including the regularization and kernel parametens).The calibration models of total flavonoids,puerarin,salvianolic acid B and icarin were established using the optimumn hyper-parameters of LS SVM.The performance of LS SVM models were compared with partial least squares(PLS)regression,feed forward back propagation network(BPANN)and support vector machine(SVM).Experimental results showed that both the calibration results and prediction accuracy of the PSO-based LS SVM method were superior to PLS,BP-ANN and SVM.For PSO-based LS-SVM models,the determination cofficients(R2)for the calibration set were above 0.9881,and the RSEP values were controlled within 5.772%.For the validation set,the RMSEP values were close to RMSEC and less than 0.042,the RSEP values were under 8.778%,which were much lower than the PLS,BP-ANN and SVM models.The PSO-based LS SVM algorithm employed in this study exhibited excellent calibration performance and prediction accuracy,which has definite practice significance and application value.展开更多
文摘A particle swarm optimization(PSO)-based least square support vector machine(LS-SVM)method was investigated for quantitative analysis of extraction solution of Y angxinshi tablet using near infrared(NIR)spectroscopy.The usable spectral region(5400-6200cm^(-1))was identified,then the first derivative spectra smoothed using a Savitzky-Golay filter were employed to establish calibration models.The PSO algorithm was applied to select the LS-SVM hyper-parameters(including the regularization and kernel parametens).The calibration models of total flavonoids,puerarin,salvianolic acid B and icarin were established using the optimumn hyper-parameters of LS SVM.The performance of LS SVM models were compared with partial least squares(PLS)regression,feed forward back propagation network(BPANN)and support vector machine(SVM).Experimental results showed that both the calibration results and prediction accuracy of the PSO-based LS SVM method were superior to PLS,BP-ANN and SVM.For PSO-based LS-SVM models,the determination cofficients(R2)for the calibration set were above 0.9881,and the RSEP values were controlled within 5.772%.For the validation set,the RMSEP values were close to RMSEC and less than 0.042,the RSEP values were under 8.778%,which were much lower than the PLS,BP-ANN and SVM models.The PSO-based LS SVM algorithm employed in this study exhibited excellent calibration performance and prediction accuracy,which has definite practice significance and application value.
