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Selecting Milk Spectra to Develop Equations to Predict Milk Technological Traits

Including all available data when developing equations to relate midinfrared spectra to a phenotype may be suboptimal for poorly represented spectra. Here, an alternative local changepoint approach was developed to predict six milk technological traits from midinfrared spectra. Neighbours were objec...

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Autores principales: Frizzarin, Maria, Gormley, Isobel Claire, Casa, Alessandro, McParland, Sinéad
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2021
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8700986/
https://www.ncbi.nlm.nih.gov/pubmed/34945635
http://dx.doi.org/10.3390/foods10123084
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author Frizzarin, Maria
Gormley, Isobel Claire
Casa, Alessandro
McParland, Sinéad
author_facet Frizzarin, Maria
Gormley, Isobel Claire
Casa, Alessandro
McParland, Sinéad
author_sort Frizzarin, Maria
collection PubMed
description Including all available data when developing equations to relate midinfrared spectra to a phenotype may be suboptimal for poorly represented spectra. Here, an alternative local changepoint approach was developed to predict six milk technological traits from midinfrared spectra. Neighbours were objectively identified for each predictand as those most similar to the predictand using the Mahalanobis distances between the spectral principal components, and subsequently used in partial least square regression (PLSR) analyses. The performance of the local changepoint approach was compared to that of PLSR using all spectra (global PLSR) and another LOCAL approach, whereby a fixed number of neighbours was used in the prediction according to the correlation between the predictand and the available spectra. Global PLSR had the lowest RMSEV for five traits. The local changepoint approach had the lowest RMSEV for one trait; however, it outperformed the LOCAL approach for four traits. When the 5% of the spectra with the greatest Mahalanobis distance from the centre of the global principal component space were analysed, the local changepoint approach outperformed the global PLSR and the LOCAL approach in two and five traits, respectively. The objective selection of neighbours improved the prediction performance compared to utilising a fixed number of neighbours; however, it generally did not outperform the global PLSR.
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spelling pubmed-87009862021-12-24 Selecting Milk Spectra to Develop Equations to Predict Milk Technological Traits Frizzarin, Maria Gormley, Isobel Claire Casa, Alessandro McParland, Sinéad Foods Article Including all available data when developing equations to relate midinfrared spectra to a phenotype may be suboptimal for poorly represented spectra. Here, an alternative local changepoint approach was developed to predict six milk technological traits from midinfrared spectra. Neighbours were objectively identified for each predictand as those most similar to the predictand using the Mahalanobis distances between the spectral principal components, and subsequently used in partial least square regression (PLSR) analyses. The performance of the local changepoint approach was compared to that of PLSR using all spectra (global PLSR) and another LOCAL approach, whereby a fixed number of neighbours was used in the prediction according to the correlation between the predictand and the available spectra. Global PLSR had the lowest RMSEV for five traits. The local changepoint approach had the lowest RMSEV for one trait; however, it outperformed the LOCAL approach for four traits. When the 5% of the spectra with the greatest Mahalanobis distance from the centre of the global principal component space were analysed, the local changepoint approach outperformed the global PLSR and the LOCAL approach in two and five traits, respectively. The objective selection of neighbours improved the prediction performance compared to utilising a fixed number of neighbours; however, it generally did not outperform the global PLSR. MDPI 2021-12-11 /pmc/articles/PMC8700986/ /pubmed/34945635 http://dx.doi.org/10.3390/foods10123084 Text en © 2021 by the authors. https://creativecommons.org/licenses/by/4.0/Licensee MDPI, Basel, Switzerland. This article is an open access article distributed under the terms and conditions of the Creative Commons Attribution (CC BY) license (https://creativecommons.org/licenses/by/4.0/).
spellingShingle Article
Frizzarin, Maria
Gormley, Isobel Claire
Casa, Alessandro
McParland, Sinéad
Selecting Milk Spectra to Develop Equations to Predict Milk Technological Traits
title Selecting Milk Spectra to Develop Equations to Predict Milk Technological Traits
title_full Selecting Milk Spectra to Develop Equations to Predict Milk Technological Traits
title_fullStr Selecting Milk Spectra to Develop Equations to Predict Milk Technological Traits
title_full_unstemmed Selecting Milk Spectra to Develop Equations to Predict Milk Technological Traits
title_short Selecting Milk Spectra to Develop Equations to Predict Milk Technological Traits
title_sort selecting milk spectra to develop equations to predict milk technological traits
topic Article
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8700986/
https://www.ncbi.nlm.nih.gov/pubmed/34945635
http://dx.doi.org/10.3390/foods10123084
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