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FT-NIR光谱应用于柚子皮果胶定量分析的波段优选 被引量:7
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作者 陈华舟 唐国强 +1 位作者 艾武 梁嘉如 《科学技术与工程》 北大核心 2013年第12期3232-3237,共6页
基于傅里叶变换近红外(FT-NIR)漫反射光谱分析技术,采用分段多元散射校正(PMSC)预处理与移动窗口偏最小二乘(MWPLS)方法为柚子皮果胶的定量分析优选波段。基于全谱进行PMSC预处理,在此基础上结合留一交叉检验技术优选21个分段窗口大小,... 基于傅里叶变换近红外(FT-NIR)漫反射光谱分析技术,采用分段多元散射校正(PMSC)预处理与移动窗口偏最小二乘(MWPLS)方法为柚子皮果胶的定量分析优选波段。基于全谱进行PMSC预处理,在此基础上结合留一交叉检验技术优选21个分段窗口大小,以此设定为MWPLS方法波段优选的窗口宽度。详细讨论先后采用或不采用MSC预处理的MWPLS模型的预测效果,并从中优选定标预测模型。最优的方案为先MWPLS选择波段,后MSC预处理再建立PLS模型,其优选波段为8 540—7 944(cm-1),窗口宽度为310,对应的最优PLS因子数为11,相应的预测均方根偏差(RMSEP)和预测相关系数(RP)分别为0.520 7(%)、0.871 1。该模型明显优于先对全谱做MSC预处理再建立MWPLS模型,且大幅度优于基于原光谱数据直接建立的MWPLS模型。结果表明,采用PMSC预处理为MWPLS方法搜索窗口宽度预设值,大大降低了MWPLS模型的运算量,有利于波段优选光谱。MWPLS模型结合MSC预处理方法可以有效地应用于柚子皮果胶成分的FT-NIR定量分析。 展开更多
关键词 ft—nir光谱 柚子皮果胶 波段优选PMSC MWPLS
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FT-NIR光谱法快速预测烟草中的游离氨基酸 被引量:7
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作者 荆磊磊 申钦鹏 +6 位作者 张涛 徐文秀 蒋丽红 刘春波 杨光宇 刘志华 缪明明 《烟草科技》 EI CAS CSCD 北大核心 2016年第1期54-59,共6页
为研究应用傅里叶变换近红外光谱(FT-NIR)法快速测定烟草中游离氨基酸质量分数的可行性,采用偏最小二乘法(PLS)作为建模方法,选择4000~9000cm^-1谱段,采用一阶导数和Norris滤波法进行光谱预处理,建立了烟草中的组氨酸、天冬酰... 为研究应用傅里叶变换近红外光谱(FT-NIR)法快速测定烟草中游离氨基酸质量分数的可行性,采用偏最小二乘法(PLS)作为建模方法,选择4000~9000cm^-1谱段,采用一阶导数和Norris滤波法进行光谱预处理,建立了烟草中的组氨酸、天冬酰胺、谷氨酰胺、脯氨酸、苯丙氨酸和色氨酸以及游离氨基酸总量的近红外预测模型;对比了近红外光谱技术和常规标准检测方法,并验证了模型偏差的显著性。结果表明:①6种氨基酸以及游离氨基酸总量的最佳PLS预测模型的相关系数(r)均大于0.9,预测标准偏差(SEP)均小于校正标准偏差(SEC)的1.2倍,验证集样本的标准偏差(SD)与SEP的比值均大于2。②烟草中的组氨酸、天冬酰胺、谷氨酰胺、脯氨酸、苯丙氨酸和色氨酸以及游离氨基酸总量校正模型的交叉验证均方差(RMSECV)分别为0.0217、0.1860、0.2020、0.8180、0.0326、0.0478和1.5920。③在显著水平0.05时,两种方法不存在显著性差异。近红外光谱技术可以准确地定量分析烟草中的6种游离氨基酸以及游离氨基酸的总量。 展开更多
关键词 傅里叶变换近红外(ft—nir)光谱 烟草 游离氨基酸 偏最小二乘法
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Measurement of sugar content in Fuji apples by FT-NIR spectroscopy 被引量:3
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作者 刘燕德 应义斌 《Journal of Zhejiang University Science》 EI CSCD 2004年第6期651-655,共5页
To evaluate the potential of FT-NIR spectroscopy and the influence of the distance between the light source/detection probe and the fruit for measuring the sugar content (SC) of Fuji apples, diffuse reflectance spectr... To evaluate the potential of FT-NIR spectroscopy and the influence of the distance between the light source/detection probe and the fruit for measuring the sugar content (SC) of Fuji apples, diffuse reflectance spectra were measured in the spectral range from 12500 to 4000 cm^-1 at 0 mm, 2 mm, 4 mm and 6 mm distances. Four calibration models at four distances were established between diffused reflectance spectra and sugar content by partial least squares (PLS) analysis. The correlation coefficients (R) of calibrations ranged from 0.982 to 0.997 with SEC values from 0.138 to 0.453 and the SECV values from 0.74 to 1.58. The best model of original spectra at 0 mm distance yielded high correlation determination of 0.918, a SEC of 0.092, and a SEP of 0.773. The results showed that different light/detection probe-fruit distances influence the apple reflective spectra and SC predictions. 展开更多
关键词 ft-nir spectroscopy Nondestructive measurement Sugar content Fuji apples Partial least squares analysis
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Application Fourier transform near infrared spectrometer in rapid estimation of soluble solids content of intact citrus fruits 被引量:5
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作者 LU Hui-shan XU Hui-rong YING Yi-bin FU Xia-ping YU Hai-yan TIAN Hai-qing 《Journal of Zhejiang University-Science B(Biomedicine & Biotechnology)》 SCIE CAS CSCD 2006年第10期794-799,共6页
Nondestructive method of measuring soluble solids content (SSC) of citrus fruits was developed using Fourier transform near infrared reflectance (FT-NIR) measurements collected through optics fiber. The models describ... Nondestructive method of measuring soluble solids content (SSC) of citrus fruits was developed using Fourier transform near infrared reflectance (FT-NIR) measurements collected through optics fiber. The models describing the relationship between SSC and the NIR spectra of citrus fruits were developed and evaluated. Different spectra correction algorithms (standard normal variate (SNV), multiplicative signal correction (MSC)) were used in this study. The relationship between laboratory SSC and FT-NIR spectra of citrus fruits was analyzed via principle component regression (PCR) and partial least squares (PLS) re- gression method. Models based on the different spectral ranges were compared in this research. The first derivative and second derivative were applied to all spectra to reduce the effects of sample size, light scattering, instrument noise, etc. Different baseline correction methods were applied to improve the spectral data quality. Among them the second derivative method after baseline correction produced best noise removing capability and yielded optimal calibration models. A total of 170 NIR spectra were acquired; 135 NIR spectra were used to develop the calibration model; the remaining spectra were used to validate the model. The developed PLS model describing the relationship between SSC and NIR reflectance spectra could predict SSC of 35 samples with correlation coefficient of 0.995 and RMSEP of 0.79 °Brix. 展开更多
关键词 ft-nir spectroscopy Soluble solids content Intact citrus Partial least squares analysis Reflectance mode
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