Article ID Journal Published Year Pages File Type
9743335 Analytica Chimica Acta 2005 7 Pages PDF
Abstract
The use of the autocorrelation function (R1) with lag 1 in univariate and multivariate model selection is proposed. In the univariate case, a Z-value is calculated from the R1 of the residual vector. A high positive value of Z indicates the presence of smooth, non-random variations in the data not explained by the model considered. In the multivariate case, a new procedure is proposed. A “short” path is found in the independent variable space, and the Z from the dependent variable residual vector is used to measure the smoothness of the changes in the dependent variable. Applications are shown for variable selection and determination of the number of latent variables in PLS1 models.
Related Topics
Physical Sciences and Engineering Chemistry Analytical Chemistry
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