Literature DB >> 33453882

Multivariate Curve Resolution: 50 years addressing the mixture analysis problem - A review.

Anna de Juan1, Romà Tauler2.   

Abstract

Multivariate Curve Resolution (MCR) covers a wide span of algorithms designed to tackle the mixture analysis problem by expressing the original data through a bilinear model of pure component meaningful contributions. Since the seminal work by Lawton and Sylvestre in 1971, MCR methods are dynamically evolving to adapt to a wealth of diverse and demanding scientific scenarios. To do so, essential concepts, such as basic constraints, have been revisited and new modeling tasks, mathematical properties and domain-specific information have been incorporated; the initial underlying bilinear model has evolved into a flexible framework where hybrid bilinear/multilinear models can coexist, the regular data structures have undergone a turn of the screw and incomplete multisets and matrix and tensor combinations can be now analyzed. Back to the fundamentals, the theoretical core of the MCR methodology is deeply understood due to the thorough studies about the ambiguity phenomenon. The adaptation of the method to new analytical measurements and scientific domains is continuous. At this point of the story, MCR can be considered a mature yet lively methodology, where many steps forward can still be taken.
Copyright © 2020 Elsevier B.V. All rights reserved.

Keywords:  -Omics data analysis; Ambiguity; Big data; Constraints; Environmental data analysis; Hyperspectral image analysis; Multidimensional chromatography; Multiset analysis; Multivariate curve resolution; Process analysis

Year:  2020        PMID: 33453882     DOI: 10.1016/j.aca.2020.10.051

Source DB:  PubMed          Journal:  Anal Chim Acta        ISSN: 0003-2670            Impact factor:   6.558


  7 in total

1.  Towards Raman imaging of centimeter scale tissue areas for real-time opto-molecular visualization of tissue boundaries for clinical applications.

Authors:  Oleksii Ilchenko; Yurii Pilhun; Andrii Kutsyk
Journal:  Light Sci Appl       Date:  2022-05-19       Impact factor: 20.257

2.  Novel Non-Invasive Quantification and Imaging of Eumelanin and DHICA Subunit in Skin Lesions by Raman Spectroscopy and MCR Algorithm: Improving Dysplastic Nevi Diagnosis.

Authors:  José Javier Ruiz; Monica Marro; Ismael Galván; José Bernabeu-Wittel; Julián Conejo-Mir; Teresa Zulueta-Dorado; Ana Belén Guisado-Gil; Pablo Loza-Álvarez
Journal:  Cancers (Basel)       Date:  2022-02-18       Impact factor: 6.639

3.  Restoring trilinearity with the purpose of advanced modeling: towards a more effective analysis of Pericarpium Citri Reticulatae during storage periods.

Authors:  Yaping Li; Qing Cao; Min He; Xinyue Yang; Pingping Zeng; Weiguo Cao
Journal:  Heliyon       Date:  2022-03-18

4.  Flexible Implementation of the Trilinearity Constraint in Multivariate Curve Resolution Alternating Least Squares (MCR-ALS) of Chromatographic and Other Type of Data.

Authors:  Xin Zhang; Romà Tauler
Journal:  Molecules       Date:  2022-04-05       Impact factor: 4.411

5.  Coherent anti-Stokes Raman scattering cell imaging and segmentation with unsupervised data analysis.

Authors:  Damien Boildieu; Tiffany Guerenne-Del Ben; Ludovic Duponchel; Vincent Sol; Jean-Michel Petit; Éric Champion; Hideaki Kano; David Helbert; Amandine Magnaudeix; Philippe Leproux; Philippe Carré
Journal:  Front Cell Dev Biol       Date:  2022-08-16

6.  Evaluation of CO2 and H2O Adsorption on a Porous Polymer Using DFT and In Situ DRIFT Spectroscopy.

Authors:  Giulia E M Schukraft; Ioanna Itskou; Robert T Woodward; Bart Van Der Linden; Camille Petit; Atsushi Urakawa
Journal:  J Phys Chem B       Date:  2022-09-28       Impact factor: 3.466

7.  Evaluation of the Miscibility of Novel Cocoa Butter Equivalents by Raman Mapping and Multivariate Curve Resolution-Alternating Least Squares.

Authors:  Efraín M Castro-Alayo; Llisela Torrejón-Valqui; Ilse S Cayo-Colca; Fiorella P Cárdenas-Toro
Journal:  Foods       Date:  2021-12-14
  7 in total

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