Metabolomics in the clinic: A review of the shared and unique features of untargeted metabolomics for clinical research and clinical testing

AD Kennedy, BM Wittmann, AM Evans… - Journal of Mass …, 2018 - Wiley Online Library
Metabolomics is the untargeted measurement of the metabolome, which is composed of the
complement of small molecules detected in a biological sample. As such, metabolomic …

Overview of mass spectrometry-based metabolomics: opportunities and challenges

GAN Gowda, D Djukovic - Mass Spectrometry in Metabolomics: Methods …, 2014 - Springer
The field of metabolomics has witnessed an exponential growth in the last decade driven by
important applications spanning a wide range of areas in the basic and life sciences and …

Toward merging untargeted and targeted methods in mass spectrometry-based metabolomics and lipidomics

T Cajka, O Fiehn - Analytical chemistry, 2016 - ACS Publications
Advances in mass spectrometry (MS) and data processing have led to discoveries in
regulation of cellular metabolism by using metabolomics and lipidomics approaches. 1, 2 …

Comparison of GC-MS and GC× GC-MS in the analysis of human serum samples for biomarker discovery

JH Winnike, X Wei, KJ Knagge… - Journal of proteome …, 2015 - ACS Publications
We compared the performance of gas chromatography time-of-flight mass spectrometry (GC-
MS) and comprehensive two-dimensional gas chromatography mass spectrometry (GC× GC …

[HTML][HTML] metaX: a flexible and comprehensive software for processing metabolomics data

B Wen, Z Mei, C Zeng, S Liu - BMC bioinformatics, 2017 - Springer
Background Non-targeted metabolomics based on mass spectrometry enables high-
throughput profiling of the metabolites in a biological sample. The large amount of data …

Metabolomics: a primer

X Liu, JW Locasale - Trends in biochemical sciences, 2017 - cell.com
Metabolomics generates a profile of small molecules that are derived from cellular
metabolism and can directly reflect the outcome of complex networks of biochemical …

Characterization of differences between blood sample matrices in untargeted metabolomics

JR Denery, AAK Nunes, TJ Dickerson - Analytical chemistry, 2011 - ACS Publications
Large-scale proteomic and metabolomic technologies are increasingly gaining attention for
their use in the diagnosis of human disease. In order to ensure the statistical power of …

LC-MS-based methodology for global metabolite profiling in metabonomics/metabolomics

G Theodoridis, HG Gika, ID Wilson - TrAC Trends in Analytical Chemistry, 2008 - Elsevier
In order to perform metabonomic investigations, it is necessary to generate comprehensive
“global” metabolite profiles from complex samples, such as biofluids and tissues/tissue …

GMD@ CSB. DB: the Golm metabolome database

J Kopka, N Schauer, S Krueger, C Birkemeyer… - …, 2005 - academic.oup.com
Metabolomics, in particular gas chromatography–mass spectrometry (GC–MS) based
metabolite profiling of biological extracts, is rapidly becoming one of the cornerstones of …

[HTML][HTML] The MetabolomeExpress Project: enabling web-based processing, analysis and transparent dissemination of GC/MS metabolomics datasets

AJ Carroll, MR Badger, A Harvey Millar - BMC bioinformatics, 2010 - Springer
Background Standardization of analytical approaches and reporting methods via community-
wide collaboration can work synergistically with web-tool development to result in rapid …