A2 Refereed review article in a scientific journal

Machine learning approaches in microbiome research: challenges and best practices




AuthorsPapoutsoglou Georgios, Tarazona Sonia, Lopes Marta B., Klammsteiner Thomas, Ibrahimi Eliana, Eckenberger Julia, Novielli Pierfrancesco, Tonda Alberto, Simeon Andrea, Shigdel Rajesh, Béreux Stéphane, Vitali Giacomo, Tangaro Sabina, Lahti Leo, Temko Andriy, Claesson Marcus J., Berland Magali

PublisherFrontiers Research Foundation

Publication year2023

JournalFrontiers in Microbiology

Journal name in sourceFRONTIERS IN MICROBIOLOGY

Journal acronymFRONT MICROBIOL

Article number1261889

Volume14

Number of pages21

eISSN1664-302X

DOIhttps://doi.org/10.3389/fmicb.2023.1261889

Web address https://doi.org/10.3389/fmicb.2023.1261889

Self-archived copy’s web addresshttps://research.utu.fi/converis/portal/detail/Publication/181463346


Abstract

Microbiome data predictive analysis within a machine learning (ML) workflow presents numerous domain-specific challenges involving preprocessing, feature selection, predictive modeling, performance estimation, model interpretation, and the extraction of biological information from the results. To assist decision-making, we offer a set of recommendations on algorithm selection, pipeline creation and evaluation, stemming from the COST Action ML4Microbiome. We compared the suggested approaches on a multi-cohort shotgun metagenomics dataset of colorectal cancer patients, focusing on their performance in disease diagnosis and biomarker discovery. It is demonstrated that the use of compositional transformations and filtering methods as part of data preprocessing does not always improve the predictive performance of a model. In contrast, the multivariate feature selection, such as the Statistically Equivalent Signatures algorithm, was effective in reducing the classification error. When validated on a separate test dataset, this algorithm in combination with random forest modeling, provided the most accurate performance estimates. Lastly, we showed how linear modeling by logistic regression coupled with visualization techniques such as Individual Conditional Expectation (ICE) plots can yield interpretable results and offer biological insights. These findings are significant for clinicians and non-experts alike in translational applications.


Downloadable publication

This is an electronic reprint of the original article.
This reprint may differ from the original in pagination and typographic detail. Please cite the original version.





Last updated on 2024-26-11 at 14:49