Multivariate Modeling Analysis Based on Partial Least Squares Regression and Principal Component Regression

Yulei Chen, Xinwei Zhang, Qi Zou, Hepeng Wang, Shisheng Huang, Liang Lu
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Abstract

In view of the high dimensionality of data in many fields and the serious multiple correlation between variables, this paper proposes an interpretable partial least square regression (PLSR) modeling method. Compared with principal component regression (PCR), when there are a large number of predictors, both PLSR and PCR model the response variables, and the predictors are highly correlated or even collinear. Both of these methods construct new predictors (called components) as linear combinations of the original predictors, but they construct these components in different ways. We use a series of cross-validation experiments to determine the number of components. This paper explores the effectiveness of the above-mentioned two methods. According to the mean square prediction error curve, when the number of components in PLSR is 3 and PCR is 4, better prediction accuracy is obtained.
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基于偏最小二乘回归和主成分回归的多元建模分析
针对许多领域数据的高维性和变量之间严重的多重相关性,本文提出了一种可解释偏最小二乘回归(PLSR)建模方法。与主成分回归(PCR)相比,当预测因子数量较多时,PLSR和PCR均对响应变量进行建模,且预测因子高度相关甚至共线性。这两种方法都将新的预测器(称为组件)构建为原始预测器的线性组合,但是它们以不同的方式构建这些组件。我们使用一系列交叉验证实验来确定组件的数量。本文探讨了上述两种方法的有效性。由均方预测误差曲线可知,当PLSR的组分数为3,PCR的组分数为4时,预测精度较好。
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