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运用主成分分析和多元回归方法对瓶装贮藏啤酒老化进行多变量建模。

Multivariate modeling of aging in bottled lager beer by principal component analysis and multiple regression methods.

作者信息

Liu Jing, Li Qi, Dong Jianjun, Chen Jian, Gu Guoxian

机构信息

Key Laboratory of Industrial Biotechnology, Ministry of Education, Jiangnan University, Wuxi, 214122, People's Republic of China.

出版信息

J Agric Food Chem. 2008 Aug 27;56(16):7106-12. doi: 10.1021/jf800879v. Epub 2008 Jul 15.

Abstract

Data collected from the sensory test score evaluation of bottled lager beer, together with the chemical components related to aging, including carbonyl compounds, higher alcohols, unsaturated fatty acid, organic acids, alpha-amino acids, dissolved oxygen, and staling evaluation indices, including lag time of electron spin resonance (ESR) curve, 1,1'-diphenyl-2-picrylhydrazyl (DPPH) scavenged amounts, and thiobarbituric acid (TBA) values, were used to predict the extent of aging in bottled lager beer, using both multiple linear regression and principal component analysis methods. Carbonyl compounds, higher alcohols, and TBA value were significantly and positively correlated with sensory evaluation of staling flavor. While lag time and DPPH scavenging amount were negatively correlated with taste test score. Multiple regression analysis was used to fit the sensory test data using the above chemical compound aging related parameters and evaluation indices as predictors. A variable selection method based on high loadings of varimax rotated principal components was used to obtain subsets of the predominant predictor variables to be included in the regression model of beer aging, so as to eliminate the multicollinearity of the original nine variables. It was found that staling extent was influenced significantly by higher alcohols, TBA value, and DPPH scavenging amount, and the multicollinearity of the regression model was found to be weak by examining the variance inflation factors of the new predictor variables. A mathematic model of the organoleptic test score for beer aging using these three predictors was obtained by multiple linear regression, showing that the major contributors to the sensory taste of beer aging were higher alcohols, TBA index, and DPPH scavenging amount, with the adjusted R(2) of the model being 0.62.

摘要

从瓶装贮藏啤酒的感官测试评分评估中收集的数据,以及与老化相关的化学成分,包括羰基化合物、高级醇、不饱和脂肪酸、有机酸、α-氨基酸、溶解氧,还有老化评估指标,包括电子自旋共振(ESR)曲线的滞后时间、1,1'-二苯基-2-苦基肼(DPPH)清除量和硫代巴比妥酸(TBA)值,被用于使用多元线性回归和主成分分析方法预测瓶装贮藏啤酒的老化程度。羰基化合物、高级醇和TBA值与陈旧风味的感官评价呈显著正相关。而滞后时间和DPPH清除量与味觉测试评分呈负相关。使用上述与化合物老化相关的参数和评估指标作为预测变量,通过多元回归分析对感官测试数据进行拟合。采用基于方差最大化旋转主成分高载荷的变量选择方法,获得要纳入啤酒老化回归模型的主要预测变量子集,以消除原始九个变量的多重共线性。结果发现,高级醇、TBA值和DPPH清除量对老化程度有显著影响,通过检查新预测变量的方差膨胀因子发现回归模型的多重共线性较弱。通过多元线性回归获得了使用这三个预测变量的啤酒老化感官测试评分的数学模型,表明啤酒老化感官味道的主要贡献因素是高级醇、TBA指数和DPPH清除量,模型的调整R(2)为0.62。

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