Metabolomics

Training material to analyse Mass spectrometry data in Galaxy: Metabolomics (LCMS, FIAMS, GCMS, NMR) and imaging.

Requirements

Before diving into this topic, we recommend you to have a look at:

Material

You can view the tutorial materials in different languages by clicking the dropdown icon next to the slides () and tutorial () buttons below.
Lesson Slides Hands-on Recordings Input dataset Workflows
Introduction to Metabolomics
Mass spectrometry imaging: Examining the spatial distribution of analytes
Mass spectrometry imaging: Finding differential analytes
Mass spectrometry: GC-MS data processing (with XCMS, RAMClustR, RIAssigner, and matchms)
Mass spectrometry: LC-MS analysis
Mass spectrometry: LC-MS data processing
Mass spectrometry: LC-MS preprocessing with XCMS
Molecular formula assignment and mass recalibration with MFAssignR package
Predicting EI+ mass spectra with QCxMS

Frequently Asked Questions

Common questions regarding this topic have been collected on a dedicated FAQ page . Common questions related to specific tutorials can be accessed from the tutorials themselves.

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Editorial Board

This material is reviewed by our Editorial Board:

Gildas Le Corguillé avatar Gildas Le CorguilléMélanie Petera avatar Mélanie Peteraorcid logoMelanie Föll avatar Melanie Föll

Contributors

This material was contributed to by:

Mélanie Petera avatar Mélanie Peteraorcid logoSaskia Hiltemann avatar Saskia Hiltemannorcid logoMelanie Föll avatar Melanie FöllJulien Saint-Vanne avatar Julien Saint-Vanneorcid logoJulia Jakiela avatar Julia JakielaJean-François Martin avatar Jean-François Martinorcid logoMatej Troják avatar Matej TrojákMaren Stillger avatar Maren Stillgerorcid logoMaxim Skoryk avatar Maxim SkorykSimon Bray avatar Simon BraySimeon Schum avatar Simeon Schumorcid logoHelge Hecht avatar Helge HechtYann Guitton avatar Yann Guittonorcid logoBjörn Grüning avatar Björn GrüningGildas Le Corguillé avatar Gildas Le Corguilléorcid logoKristina Gomoryova avatar Kristina GomoryovaWorkflow4Metabolomics core team avatar Workflow4Metabolomics core teamorcid logoBérénice Batut avatar Bérénice Batutorcid logoHelena Rasche avatar Helena RascheCécile Canlet avatar Cécile Canlet

Funding

These individuals or organisations provided funding support for the development of this resource

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UFR
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ELIXIR Europe