IonFlow: a galaxy tool for the analysis of ionomics data sets.


Journal

Metabolomics : Official journal of the Metabolomic Society
ISSN: 1573-3890
Titre abrégé: Metabolomics
Pays: United States
ID NLM: 101274889

Informations de publication

Date de publication:
25 09 2021
Historique:
received: 09 05 2021
accepted: 13 09 2021
entrez: 25 9 2021
pubmed: 26 9 2021
medline: 19 1 2022
Statut: epublish

Résumé

Inductively coupled plasma mass spectrometry (ICP-MS) experiments generate complex multi-dimensional data sets that require specialist data analysis tools. Here we describe tools to facilitate analysis of the ionome composed of high-throughput elemental profiling data. IonFlow is a Galaxy tool written in R for ionomics data analysis and is freely accessible at https://github.com/wanchanglin/ionflow . It is designed as a pipeline that can process raw data to enable exploration and interpretation using multivariate statistical techniques and network-based algorithms, including principal components analysis, hierarchical clustering, relevance network extraction and analysis, and gene set enrichment analysis. The pipeline is described and tested on two benchmark data sets of the haploid S. Cerevisiae ionome and of the human HeLa cell ionome.

Identifiants

pubmed: 34562172
doi: 10.1007/s11306-021-01841-z
pii: 10.1007/s11306-021-01841-z
pmc: PMC8464566
doi:

Types de publication

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

Langues

eng

Sous-ensembles de citation

IM

Pagination

91

Subventions

Organisme : Medical Research Council
ID : MR/P011705/2
Pays : United Kingdom
Organisme : Medical Research Council
ID : MR/P011705/1
Pays : United Kingdom
Organisme : Wellcome Trust
Pays : United Kingdom
Organisme : Wellcome Trust
ID : 202952/D/16/Z
Pays : United Kingdom
Organisme : Medical Research Council
ID : MC_UP_A090_1006
Pays : United Kingdom

Informations de copyright

© 2021. The Author(s).

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Auteurs

J Iacovacci (J)

Department of Metabolism Digestion and Reproduction, Faculty of Medicine, Imperial College London, London, UK. j.iacovacci@imperial.ac.uk.
Breast Cancer Now Toby Robins Research Centre, The Institute of Cancer Research, London, UK. j.iacovacci@imperial.ac.uk.

W Lin (W)

Department of Metabolism Digestion and Reproduction, Faculty of Medicine, Imperial College London, London, UK.

J L Griffin (JL)

Department of Metabolism Digestion and Reproduction, Faculty of Medicine, Imperial College London, London, UK.
Department of Biochemistry and Systems Biology Centre, University of Cambridge, Cambridge, UK.

R C Glen (RC)

Department of Metabolism Digestion and Reproduction, Faculty of Medicine, Imperial College London, London, UK. r.glen@imperial.ac.uk.
Department of Chemistry, Centre for Molecular Informatics, University of Cambridge, Cambridge, UK. r.glen@imperial.ac.uk.

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Classifications MeSH