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Determination of the superficial citral content on microparticles: An application of NIR spectroscopy coupled with chemometric tools

This work evaluates near-infrared (NIR) spectroscopy coupled with chemometric tools for determining the superficial content of citral ([Formula: see text]) on microparticles. To perform this evaluation, using spray drying, citral was encapsulated in a matrix of dextrin using twelve combinations of c...

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Detalles Bibliográficos
Autores principales: Yoplac, Ives, Avila-George, Himer, Vargas, Luis, Robert, Paz, Castro, Wilson
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Elsevier 2019
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6675954/
https://www.ncbi.nlm.nih.gov/pubmed/31388576
http://dx.doi.org/10.1016/j.heliyon.2019.e02122
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author Yoplac, Ives
Avila-George, Himer
Vargas, Luis
Robert, Paz
Castro, Wilson
author_facet Yoplac, Ives
Avila-George, Himer
Vargas, Luis
Robert, Paz
Castro, Wilson
author_sort Yoplac, Ives
collection PubMed
description This work evaluates near-infrared (NIR) spectroscopy coupled with chemometric tools for determining the superficial content of citral ([Formula: see text]) on microparticles. To perform this evaluation, using spray drying, citral was encapsulated in a matrix of dextrin using twelve combinations of citral:dextrin ratios (CDR) and inlet air temperatures (IAT). From each treatment, six samples were extracted, and their [Formula: see text] and NIR absorption spectral profiles were measured. Then, the spectral profiles, pretreated and randomly divided into modeling and validation datasets, were used to build the following prediction models: principal component analysis-multilinear regression (PCA-MLR), principal component analysis-artificial neural network (PCA-ANN), partial least squares regression (PLSR) and an artificial neural network (ANN). During the validation stage, the models showed [Formula: see text] values from 0.73 to 0.96 and a root mean squared error (RMSE) range of [0.061–0.140]. Moreover, when the models were compared, the full and optimized ANN models showed the best fits. According to this study, NIR coupled with chemometric tools has the potential for application in determining [Formula: see text] on microparticles, particularly when using ANN models.
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spelling pubmed-66759542019-08-06 Determination of the superficial citral content on microparticles: An application of NIR spectroscopy coupled with chemometric tools Yoplac, Ives Avila-George, Himer Vargas, Luis Robert, Paz Castro, Wilson Heliyon Article This work evaluates near-infrared (NIR) spectroscopy coupled with chemometric tools for determining the superficial content of citral ([Formula: see text]) on microparticles. To perform this evaluation, using spray drying, citral was encapsulated in a matrix of dextrin using twelve combinations of citral:dextrin ratios (CDR) and inlet air temperatures (IAT). From each treatment, six samples were extracted, and their [Formula: see text] and NIR absorption spectral profiles were measured. Then, the spectral profiles, pretreated and randomly divided into modeling and validation datasets, were used to build the following prediction models: principal component analysis-multilinear regression (PCA-MLR), principal component analysis-artificial neural network (PCA-ANN), partial least squares regression (PLSR) and an artificial neural network (ANN). During the validation stage, the models showed [Formula: see text] values from 0.73 to 0.96 and a root mean squared error (RMSE) range of [0.061–0.140]. Moreover, when the models were compared, the full and optimized ANN models showed the best fits. According to this study, NIR coupled with chemometric tools has the potential for application in determining [Formula: see text] on microparticles, particularly when using ANN models. Elsevier 2019-07-30 /pmc/articles/PMC6675954/ /pubmed/31388576 http://dx.doi.org/10.1016/j.heliyon.2019.e02122 Text en © 2019 The Authors http://creativecommons.org/licenses/by-nc-nd/4.0/ This is an open access article under the CC BY-NC-ND license (http://creativecommons.org/licenses/by-nc-nd/4.0/).
spellingShingle Article
Yoplac, Ives
Avila-George, Himer
Vargas, Luis
Robert, Paz
Castro, Wilson
Determination of the superficial citral content on microparticles: An application of NIR spectroscopy coupled with chemometric tools
title Determination of the superficial citral content on microparticles: An application of NIR spectroscopy coupled with chemometric tools
title_full Determination of the superficial citral content on microparticles: An application of NIR spectroscopy coupled with chemometric tools
title_fullStr Determination of the superficial citral content on microparticles: An application of NIR spectroscopy coupled with chemometric tools
title_full_unstemmed Determination of the superficial citral content on microparticles: An application of NIR spectroscopy coupled with chemometric tools
title_short Determination of the superficial citral content on microparticles: An application of NIR spectroscopy coupled with chemometric tools
title_sort determination of the superficial citral content on microparticles: an application of nir spectroscopy coupled with chemometric tools
topic Article
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6675954/
https://www.ncbi.nlm.nih.gov/pubmed/31388576
http://dx.doi.org/10.1016/j.heliyon.2019.e02122
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