Guiding the choice of informatics software and tools for lipidomics research applications.


Journal

Nature methods
ISSN: 1548-7105
Titre abrégé: Nat Methods
Pays: United States
ID NLM: 101215604

Informations de publication

Date de publication:
02 2023
Historique:
received: 24 05 2022
accepted: 02 11 2022
pubmed: 22 12 2022
medline: 14 2 2023
entrez: 21 12 2022
Statut: ppublish

Résumé

Progress in mass spectrometry lipidomics has led to a rapid proliferation of studies across biology and biomedicine. These generate extremely large raw datasets requiring sophisticated solutions to support automated data processing. To address this, numerous software tools have been developed and tailored for specific tasks. However, for researchers, deciding which approach best suits their application relies on ad hoc testing, which is inefficient and time consuming. Here we first review the data processing pipeline, summarizing the scope of available tools. Next, to support researchers, LIPID MAPS provides an interactive online portal listing open-access tools with a graphical user interface. This guides users towards appropriate solutions within major areas in data processing, including (1) lipid-oriented databases, (2) mass spectrometry data repositories, (3) analysis of targeted lipidomics datasets, (4) lipid identification and (5) quantification from untargeted lipidomics datasets, (6) statistical analysis and visualization, and (7) data integration solutions. Detailed descriptions of functions and requirements are provided to guide customized data analysis workflows.

Identifiants

pubmed: 36543939
doi: 10.1038/s41592-022-01710-0
pii: 10.1038/s41592-022-01710-0
pmc: PMC10263382
mid: NIHMS1899835
doi:

Substances chimiques

Lipids 0

Types de publication

Journal Article Review Research Support, N.I.H., Extramural Research Support, Non-U.S. Gov't

Langues

eng

Sous-ensembles de citation

IM

Pagination

193-204

Subventions

Organisme : NIGMS NIH HHS
ID : R35 GM130385
Pays : United States
Organisme : NCI NIH HHS
ID : U01 CA235493
Pays : United States
Organisme : NHLBI NIH HHS
ID : U01 HL148860
Pays : United States
Organisme : Wellcome Trust
ID : 203014/Z/16/Z
Pays : United Kingdom

Informations de copyright

© 2022. Springer Nature America, Inc.

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Auteurs

Zhixu Ni (Z)

Center of Membrane Biochemistry and Lipid Research, Faculty of Medicine Carl Gustav Carus of TU Dresden, Dresden, Germany.

Michele Wölk (M)

Center of Membrane Biochemistry and Lipid Research, Faculty of Medicine Carl Gustav Carus of TU Dresden, Dresden, Germany.

Geoff Jukes (G)

Systems Immunity Research Institute, School of Medicine, Cardiff University, Cardiff, UK.

Karla Mendivelso Espinosa (K)

Systems Immunity Research Institute, School of Medicine, Cardiff University, Cardiff, UK.

Robert Ahrends (R)

Department of Analytical Chemistry, University of Vienna, Vienna, Austria.

Lucila Aimo (L)

Swiss-Prot group, SIB Swiss Institute of Bioinformatics, Centre Medical Universitaire, Geneva, Switzerland.

Jorge Alvarez-Jarreta (J)

Systems Immunity Research Institute, School of Medicine, Cardiff University, Cardiff, UK.
European Molecular Biology Laboratory, European Bioinformatics Institute, Wellcome Genome Campus, Hinxton, UK.

Simon Andrews (S)

Babraham Institute, Babraham Research Campus, Cambridge, UK.

Robert Andrews (R)

Systems Immunity Research Institute, School of Medicine, Cardiff University, Cardiff, UK.

Alan Bridge (A)

Swiss-Prot group, SIB Swiss Institute of Bioinformatics, Centre Medical Universitaire, Geneva, Switzerland.

Geremy C Clair (GC)

Biological Science Division, Pacific Northwest National Laboratory, Richland, WA, USA.

Matthew J Conroy (MJ)

Systems Immunity Research Institute, School of Medicine, Cardiff University, Cardiff, UK.

Eoin Fahy (E)

Department of Bioengineering, University of California, San Diego, CA, USA.

Caroline Gaud (C)

Babraham Institute, Babraham Research Campus, Cambridge, UK.

Laura Goracci (L)

Department of Chemistry, Biology and Biotechnology, University of Perugia, Perugia, Italy.

Jürgen Hartler (J)

Institute of Pharmaceutical Sciences, University of Graz, Graz, Austria.
Field of Excellence BioHealthe-University of Graz, Graz, Austria.

Nils Hoffmann (N)

Center for Biotechnology, University of Bielefeld, Bielefeld, Germany.

Dominik Kopczyinki (D)

Department of Analytical Chemistry, University of Vienna, Vienna, Austria.

Ansgar Korf (A)

Bruker Daltonics GmbH & Co. KG, Bremen, Germany.

Andrea F Lopez-Clavijo (AF)

Babraham Institute, Babraham Research Campus, Cambridge, UK.

Adnan Malik (A)

European Molecular Biology Laboratory, European Bioinformatics Institute, Wellcome Genome Campus, Hinxton, UK.

Jacobo Miranda Ackerman (JM)

Max Planck Institute of Molecular Cell Biology and Genetics, Dresden, Germany.

Martijn R Molenaar (MR)

Structural and Computational Biology Unit, European Molecular Biology Laboratory, Heidelberg, Germany.

Claire O'Donovan (C)

European Molecular Biology Laboratory, European Bioinformatics Institute, Wellcome Genome Campus, Hinxton, UK.

Tomáš Pluskal (T)

Institute of Organic Chemistry and Biochemistry of the Czech Academy of Sciences, Prague, Czech Republic.

Andrej Shevchenko (A)

Max Planck Institute of Molecular Cell Biology and Genetics, Dresden, Germany.

Denise Slenter (D)

Department of Bioinformatics - BiGCaT, NUTRIM, Maastricht University, Maastricht, The Netherlands.

Gary Siuzdak (G)

Scripps Center for Metabolomics and Mass Spectrometry, The Scripps Research Institute, La Jolla, CA, USA.

Martina Kutmon (M)

Department of Bioinformatics - BiGCaT, NUTRIM, Maastricht University, Maastricht, The Netherlands.
Maastricht Centre for Systems Biology, Maastricht University, Maastricht, The Netherlands.

Hiroshi Tsugawa (H)

Department of Biotechnology and Life Science, Tokyo University of Agriculture and Technology, Tokyo, Japan.
RIKEN Center for Sustainable Resource Science, Yokohama, Japan.
RIKEN Center for Integrative Medical Sciences, Yokohama, Japan.
Graduate School of Medical Life Science, Yokohama City University, Yokohama, Japan.

Egon L Willighagen (EL)

Department of Bioinformatics - BiGCaT, NUTRIM, Maastricht University, Maastricht, The Netherlands.

Jianguo Xia (J)

Institute of Parasitology, McGill University, Montreal, Canada.

Valerie B O'Donnell (VB)

Systems Immunity Research Institute, School of Medicine, Cardiff University, Cardiff, UK. O-DonnellVB@cardiff.ac.uk.

Maria Fedorova (M)

Center of Membrane Biochemistry and Lipid Research, Faculty of Medicine Carl Gustav Carus of TU Dresden, Dresden, Germany. maria.fedorova@tu-dresden.de.

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Classifications MeSH