Systems level studies of mammalian metabolomes: the roles of mass spectrometry and nuclear magnetic resonance spectroscopy

WB Dunn, DI Broadhurst, HJ Atherton… - Chemical society …, 2011 - pubs.rsc.org
The study of biological systems in a holistic manner (systems biology) is increasingly being
viewed as a necessity to provide qualitative and quantitative descriptions of the emergent …

NMR and pattern recognition methods in metabolomics: from data acquisition to biomarker discovery: a review

A Smolinska, L Blanchet, LMC Buydens… - Analytica chimica …, 2012 - Elsevier
Metabolomics is the discipline where endogenous and exogenous metabolites are
assessed, identified and quantified in different biological samples. Metabolites are crucial …

[HTML][HTML] The human urine metabolome

S Bouatra, F Aziat, R Mandal, AC Guo, MR Wilson… - PloS one, 2013 - journals.plos.org
Urine has long been a “favored” biofluid among metabolomics researchers. It is sterile, easy-
to-obtain in large volumes, largely free from interfering proteins or lipids and chemically …

Metabolic profiling, metabolomic and metabonomic procedures for NMR spectroscopy of urine, plasma, serum and tissue extracts

O Beckonert, HC Keun, TMD Ebbels, J Bundy… - Nature protocols, 2007 - nature.com
Metabolic profiling, metabolomic and metabonomic studies mainly involve the
multicomponent analysis of biological fluids, tissue and cell extracts using NMR …

[КНИГА][B] NMR studies of translational motion: principles and applications

WS Price - 2009 - books.google.com
Translational motion in solution, either diffusion or fluid flow, is at the heart of chemical and
biochemical reactivity. Nuclear Magnetic Resonance (NMR) provides a powerful non …

Pulsed-field gradient nuclear magnetic resonance measurements (PFG NMR) for diffusion ordered spectroscopy (DOSY) map**

G Pagès, V Gilard, R Martino, M Malet-Martino - Analyst, 2017 - pubs.rsc.org
While NMR is the most used analytical method for determining the molecular structure of
isolated chemical entities, small compounds as well as macromolecules, its capability of …

Can NMR solve some significant challenges in metabolomics?

GAN Gowda, D Raftery - Journal of Magnetic Resonance, 2015 - Elsevier
The field of metabolomics continues to witness rapid growth driven by fundamental studies,
methods development, and applications in a number of disciplines that include biomedical …

Natural organic matter and the event horizon of mass spectrometry

N Hertkorn, M Frommberger, M Witt, BP Koch… - Analytical …, 2008 - ACS Publications
Soils, sediments, freshwaters, and marine waters contain natural organic matter (NOM), an
exceedingly complex mixture of organic compounds that collectively exhibit a nearly …

Identifying unknown metabolites using NMR-based metabolic profiling techniques

I Garcia-Perez, JM Posma, JI Serrano-Contreras… - Nature …, 2020 - nature.com
Metabolic profiling of biological samples provides important insights into multiple
physiological and pathological processes but is hindered by a lack of automated annotation …

Recursive Segment-Wise Peak Alignment of Biological 1H NMR Spectra for Improved Metabolic Biomarker Recovery

KA Veselkov, JC Lindon, TMD Ebbels… - Analytical …, 2009 - ACS Publications
Chemical shift variation in small-molecule 1H NMR signals of biofluids complicates
biomarker information recovery in metabonomic studies when using multivariate statistical …