Extending the breadth of metabolite profiling by gas chromatography coupled to mass spectrometry

O Fiehn - TrAC Trends in Analytical Chemistry, 2008 - Elsevier
Gas chromatography coupled to mass spectrometry (GC-MS) is one of the most frequently
used tools for profiling primary metabolites. Instruments are mature enough to run large …

Metabolomics by gas chromatography–mass spectrometry: Combined targeted and untargeted profiling

O Fiehn - Current protocols in molecular biology, 2016 - Wiley Online Library
Gas chromatography–mass spectrometry (GC‐MS)–based metabolomics is ideal for
identifying and quantitating small‐molecule metabolites (< 650 Da), including small acids …

[HTML][HTML] GC–MS libraries for the rapid identification of metabolites in complex biological samples

N Schauer, D Steinhauser, S Strelkov, D Schomburg… - FEBS letters, 2005 - Elsevier
Gas chromatography–mass spectrometry based metabolite profiling of biological samples is
rapidly becoming one of the cornerstones of functional genomics and systems biology. Thus …

TagFinder for the quantitative analysis of gas chromatography—mass spectrometry (GC-MS)-based metabolite profiling experiments

A Luedemann, K Strassburg, A Erban, J Kopka - Bioinformatics, 2008 - academic.oup.com
Abstract Motivation: Typical GC-MS-based metabolite profiling experiments may comprise
hundreds of chromatogram files, which each contain up to 1000 mass spectral tags (MSTs) …

Gas chromatography-mass spectrometry (GC-MS)-based metabolomics

A Garcia, C Barbas - Metabolic profiling: Methods and protocols, 2011 - Springer
Metabolic fingerprinting, the main tool in metabolomics, is a non-targeted methodology
where all detectable peaks (or signals), including those from unknown analytes, are …

TargetSearch-a Bioconductor package for the efficient preprocessing of GC-MS metabolite profiling data

A Cuadros-Inostroza, C Caldana, H Redestig… - BMC …, 2009 - Springer
Background Metabolite profiling, the simultaneous quantification of multiple metabolites in
an experiment, is becoming increasingly popular, particularly with the rise of systems-level …

Current challenges and developments in GC–MS based metabolite profiling technology

J Kopka - Journal of biotechnology, 2006 - Elsevier
Gas chromatography–mass spectrometry (GC–MS) based metabolite profiling of biological
samples is one of the key technologies for metabolite profiling and substantially contributes …

metaMS: An open-source pipeline for GC–MS-based untargeted metabolomics

R Wehrens, G Weingart, F Mattivi - Journal of Chromatography B, 2014 - Elsevier
Untargeted metabolomics are rapidly becoming an important tool for studying complex
biological samples. Gas chromatography–mass spectrometry (GC–MS) is the most widely …

Practical non-targeted gas chromatography/mass spectrometry-based metabolomics platform for metabolic phenotype analysis

H Tsugawa, T Bamba, M Shinohara, S Nishiumi… - Journal of bioscience …, 2011 - Elsevier
Gas chromatography coupled to mass spectrometry (GC/MS) is a core analytical method for
metabolomics and has been used as a platform in non-targeted analysis, especially for …

Nonsupervised construction and application of mass spectral and retention time index libraries from time-of-flight gas chromatography-mass spectrometry metabolite …

A Erban, N Schauer, AR Fernie, J Kopka - Metabolomics: methods and …, 2007 - Springer
Gas chromatography-mass spectrometry (GC-MS) is routinely applied to the metabolite
profiling of biological samples. Time-of-flight (TOF)-GC-MS metabolite profiling is based on …