Journal of Chemometrics

Early View Articles

Research Articles

Improved formulation of the latent variable model inversion–based optimization problem for quality by design applications

  • Author: Daniel Palací‐López, Pedro Villalba, Pierantonio Facco, Massimiliano Barolo, Alberto Ferrer
  • Pub Online: Feb 27, 2020
  • DOI: 10.1002/cem.3230 (p )


Different strategies for the use of random forest in NMR spectra

  • Author: Betina P.O. Lovatti, Márcia H.C. Nascimento, Karla P. Rainha, Emanuele C.S. Oliveira, Álvaro C. Neto, Eustáquio V.R. Castro, Paulo R. Filgueiras
  • Pub Online: Mar 03, 2020
  • DOI: 10.1002/cem.3231 (p )

Research Articles

Coherent point drift peak alignment algorithms using distance and similarity measures for two‐dimensional gas chromatography mass spectrometry data

  • Author: Zeyu Li, Seongho Kim, Sikai Zhong, Zichun Zhong, Ikuko Kato, Xiang Zhang
  • Pub Online: Mar 28, 2020
  • DOI: 10.1002/cem.3236 (p )


Model selection challenges with application to multivariate calibration updating methods

  • Author: Anit Gurung, John H. Kalivas
  • Pub Online: Apr 27, 2020
  • DOI: 10.1002/cem.3245 (p )

Detection and discrimination of Carica papaya fungi through the analysis of volatile metabolites by gas chromatography and analysis of variance‐principal component analysis

  • Author: Larissa R. Terra, Sonia C.N. Queiroz, Daniel Terao, Márcia M.C. Ferreira
  • Pub Online: Apr 30, 2020
  • DOI: 10.1002/cem.3244 (p )

Sequential and orthogonalized PLS (SO‐PLS) regression for path analysis: Order of blocks and relations between effects

  • Author: Tormod Næs, Rosaria Romano, Oliver Tomic, Ingrid Måge, Age Smilde, Kristian H. Liland
  • Pub Online: May 04, 2020
  • DOI: 10.1002/cem.3243 (p )

The chemometrics column

Why we should be interested in P values and hypothesis tests

  • Author: Richard G. Brereton
  • Pub Online: May 08, 2020
  • DOI: 10.1002/cem.3238 (p )

P values and Ronald Fisher

  • Author: Richard G. Brereton
  • Pub Online: May 14, 2020
  • DOI: 10.1002/cem.3239 (p )

Alpha, beta, type 1 and 2 errors, Ergon Pearson and Jerzy Neyman

  • Author: Richard G. Brereton
  • Pub Online: May 15, 2020
  • DOI: 10.1002/cem.3240 (p )


Two‐stage approach for the inference of the source of high‐dimensional and complex chemical data in forensic science

  • Author: Madeline A. Ausdemore, Cedric Neumann, Christopher P. Saunders, Douglas Armstrong, Cyril Muehlethaler
  • Pub Online: May 21, 2020
  • DOI: 10.1002/cem.3247 (p )

CATTELL'S parallel proportional profiles

  • Author: Pieter M. Kroonenberg, Richard A. Harshman
  • Pub Online: May 22, 2020
  • DOI: 10.1002/cem.3235 (p )

Research Articles

Laser‐induced breakdown spectroscopy applied to the rapid identification of different types of polyethylene used for toy manufacturing

  • Author: Vinicius Câmara Costa, Fabíola Manhas Verbi Pereira
  • Pub Online: Apr 27, 2020
  • DOI: 10.1002/cem.3248 (p )

The chemometrics column

False discovery rates, power and related concepts

  • Author: Richard G. Brereton
  • Pub Online: May 15, 2020
  • DOI: 10.1002/cem.3241 (p )


Chemometrics‐assisted color histogram‐based analytical systems

  • Author: Paulo Henrique Gonçalves Dias Diniz
  • Pub Online: Apr 20, 2020
  • DOI: 10.1002/cem.3242 (p )

Research Articles

Relevant and irrelevant predictors in PLS2

  • Author: Matteo Stocchero
  • Pub Online: Apr 07, 2020
  • DOI: 10.1002/cem.3237 (p )
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