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A graphical user interface for variable selection employing the Successive Projections Algorithm

delete2012-08-01
delete46
PRE
AI
H
Henrique Mohallem Paiva
S
Sófacles Figueredo Carreiro Soares
R
Roberto Kawakami Harrop Galvão
M
Mário César Ugulino de Araújo *
DOI:10.1016/j.chemolab.2012.05.014delete
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摘要

摘要

En 中文
The present work describes a MATLAB graphical user interface for the Successive Projections Algorithm (SPA), which is a variable selection technique aimed at reducing collinearity problems in Multiple Linear Regression (MLR) modelling. The interface also offers the possibility of pre-processing the data using Savitzky-Golay smoothing/differentiation and/or wavelet denoising. Sample selection routines for dividing the samples into calibration and validation sets are also implemented. At the end, prediction statistics (PRESS, RMSEP, SDV, WAS and correlation coefficient) are calculated to evaluate the performance of the resulting MLR model. All these operations can be carried out by the user without the need for MATLAB programming skills. For illustration, an example involving near-infrared spectrometric determination of moisture in corn samples is presented. The software is freely available at www.ele.ita.br/similar to kawakami/spa. (C) 2012 Elsevier B.V. All rights reserved.
Keyword:
Multivariate calibration
Variable selection
Successive Projections Algorithm
Graphical user interface
MATLAB

期刊

Chemometrics and Intelligent Laboratory Systems 封面图
Chemometrics and Intelligent Laboratory Systems
IF:
3.8
论文数:
4.6K
被引数:
1.2W

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instituto tecnologico de aeronautica (ita)
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universidade federal da paraiba
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C
comando-geral de tecnologia aeroespacial (cta)
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