Analysis of high-dimensional metabolomics data with complex temporal dynamics using RM-ASCA.


Journal

PLoS computational biology
ISSN: 1553-7358
Titre abrégé: PLoS Comput Biol
Pays: United States
ID NLM: 101238922

Informations de publication

Date de publication:
06 2023
Historique:
received: 01 12 2022
accepted: 26 05 2023
revised: 06 07 2023
medline: 10 7 2023
pubmed: 23 6 2023
entrez: 23 6 2023
Statut: epublish

Résumé

The intricate dependency structure of biological "omics" data, particularly those originating from longitudinal intervention studies with frequently sampled repeated measurements renders the analysis of such data challenging. The high-dimensionality, inter-relatedness of multiple outcomes, and heterogeneity in the studied systems all add to the difficulty in deriving meaningful information. In addition, the subtle differences in dynamics often deemed meaningful in nutritional intervention studies can be particularly challenging to quantify. In this work we demonstrate the use of quantitative longitudinal models within the repeated-measures ANOVA simultaneous component analysis+ (RM-ASCA+) framework to capture the dynamics in frequently sampled longitudinal data with multivariate outcomes. We illustrate the use of linear mixed models with polynomial and spline basis expansion of the time variable within RM-ASCA+ in order to quantify non-linear dynamics in a simulation study as well as in a metabolomics data set. We show that the proposed approach presents a convenient and interpretable way to systematically quantify and summarize multivariate outcomes in longitudinal studies while accounting for proper within subject dependency structures.

Identifiants

pubmed: 37352364
doi: 10.1371/journal.pcbi.1011221
pii: PCOMPBIOL-D-22-01757
pmc: PMC10325080
doi:

Types de publication

Journal Article Research Support, Non-U.S. Gov't

Langues

eng

Sous-ensembles de citation

IM

Pagination

e1011221

Informations de copyright

Copyright: © 2023 Erdős et al. This is an open access article distributed under the terms of the Creative Commons Attribution License, which permits unrestricted use, distribution, and reproduction in any medium, provided the original author and source are credited.

Déclaration de conflit d'intérêts

The authors have declared that no competing interests exist.

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Auteurs

Balázs Erdős (B)

Maastricht Centre for Systems Biology (MaCSBio), Maastricht University, Maastricht, The Netherlands.

Johan A Westerhuis (JA)

Biosystems Data Analysis Group, Swammerdam Institute for Life Sciences, University of Amsterdam, Amsterdam, The Netherlands.

Michiel E Adriaens (ME)

Maastricht Centre for Systems Biology (MaCSBio), Maastricht University, Maastricht, The Netherlands.

Shauna D O'Donovan (SD)

Dept. of Biomedical Engineering, Eindhoven University of Technology, Eindhoven, The Netherlands.

Ren Xie (R)

Netherlands Cancer Institute, Amsterdam, The Netherlands.

Cécile M Singh-Povel (CM)

FrieslandCampina, Amersfoort, The Netherlands.

Age K Smilde (AK)

Biosystems Data Analysis Group, Swammerdam Institute for Life Sciences, University of Amsterdam, Amsterdam, The Netherlands.

Ilja C W Arts (ICW)

Maastricht Centre for Systems Biology (MaCSBio), Maastricht University, Maastricht, The Netherlands.

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Classifications MeSH