Publications by authors named "John C Lindon"

100Publications

Improved Spatial Resolution of Metabolites in Tissue Biopsies Using High-Resolution Magic-Angle-Spinning Slice Localization NMR Spectroscopy.

Anal Chem 2020 09 20;92(17):11516-11519. Epub 2020 Aug 20.

Section of Nutrition Research, Division of Digestive Diseases, Department of Metabolism, Digestion and Reproduction, Faculty of Medicine, Imperial College London, Sir Alexander Fleming Building, South Kensington Campus, London SW7 2AZ, United Kingdom.

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http://dx.doi.org/10.1021/acs.analchem.0c02377DOI Listing
September 2020

Identifying unknown metabolites using NMR-based metabolic profiling techniques.

Nat Protoc 2020 08 17;15(8):2538-2567. Epub 2020 Jul 17.

The Australian National Phenome Center, Health Futures Institute, Murdoch University, Perth, Western Australia, Australia.

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http://dx.doi.org/10.1038/s41596-020-0343-3DOI Listing
August 2020

Can joint fluid metabolic profiling (or "metabonomics") reveal biomarkers for osteoarthritis and inflammatory joint disease?: A systematic review.

Bone Joint Res 2020 Mar 16;9(3):108-119. Epub 2020 May 16.

Department of Surgery and Cancer, Imperial College London, and Department of Orthopaedics & Trauma, Imperial College Healthcare NHS Trust, London, UK.

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http://dx.doi.org/10.1302/2046-3758.93.BJR-2019-0167.R1DOI Listing
http://www.ncbi.nlm.nih.gov/pmc/articles/PMC7229296PMC
March 2020

Kinetic modelling of acyl glucuronide and glucoside reactivity and development of structure-property relationships.

Org Biomol Chem 2020 02;18(7):1389-1401

Department of Metabolism, Digestion and Reproduction, Faculty of Medicine, Imperial College London, Sir Alexander Fleming Building, South Kensington, London, SW7 2AZ, UK.

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http://dx.doi.org/10.1039/c9ob02008jDOI Listing
February 2020

A Unified Conceptual Framework for Metabolic Phenotyping in Diagnosis and Prognosis.

Trends Pharmacol Sci 2019 10 9;40(10):763-773. Epub 2019 Sep 9.

Division of Computational and Systems Medicine and Medical Research Council (MRC) National Institute for Health Research (NIHR) National Phenome Centre, Department of Metabolism, Digestion and Reproduction, Faculty of Medicine, Imperial College London, London SW7 2AZ, UK. Electronic address:

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http://dx.doi.org/10.1016/j.tips.2019.08.004DOI Listing
October 2019

Application of novel solid phase extraction-NMR protocols for metabolic profiling of human urine.

Faraday Discuss 2019 08;218(0):395-416

Division of Computational and Systems Medicine, Department of Surgery and Cancer, Faculty of Medicine, Imperial College London, South Kensington Campus, London SW7 2AZ, UK.

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http://xlink.rsc.org/?DOI=C8FD00220G
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http://dx.doi.org/10.1039/c8fd00220gDOI Listing
August 2019

A comparison of human serum and plasma metabolites using untargeted H NMR spectroscopy and UPLC-MS.

Metabolomics 2018 02 13;14(3):32. Epub 2018 Feb 13.

Department of Pathology and Laboratory Medicine, The Robert Larner, M.D. College of Medicine at The University of Vermont, Burlington, VT, 05446, USA.

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http://dx.doi.org/10.1007/s11306-018-1332-1DOI Listing
http://www.ncbi.nlm.nih.gov/pmc/articles/PMC7122646PMC
February 2018

Quantitative Lipoprotein Subclass and Low Molecular Weight Metabolite Analysis in Human Serum and Plasma by H NMR Spectroscopy in a Multilaboratory Trial.

Anal Chem 2018 10 27;90(20):11962-11971. Epub 2018 Sep 27.

The Imperial Clinical Phenotyping Centre, Division of Integrative Systems Medicine and Digestive Disease, Department of Surgery and Cancer , QEQM Building, Saint Mary's Hospital , London W2 1NY , United Kingdom.

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http://dx.doi.org/10.1021/acs.analchem.8b02412DOI Listing
October 2018

Optimized Phenotypic Biomarker Discovery and Confounder Elimination via Covariate-Adjusted Projection to Latent Structures from Metabolic Spectroscopy Data.

J Proteome Res 2018 04 27;17(4):1586-1595. Epub 2018 Feb 27.

Department of Preventive Medicine, Feinberg School of Medicine , Northwestern University , Chicago , Illinois 60611 , United States.

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http://dx.doi.org/10.1021/acs.jproteome.7b00879DOI Listing
http://www.ncbi.nlm.nih.gov/pmc/articles/PMC5891819PMC
April 2018

Integrated Analytical and Statistical Two-Dimensional Spectroscopy Strategy for Metabolite Identification: Application to Dietary Biomarkers.

Anal Chem 2017 03 10;89(6):3300-3309. Epub 2017 Mar 10.

Section of Biomolecular Medicine, Division of Computational and Systems Medicine, Department of Surgery and Cancer, Faculty of Medicine, South Kensington Campus, Imperial College London , London SW7 2AZ, United Kingdom.

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http://dx.doi.org/10.1021/acs.analchem.6b03324DOI Listing
http://www.ncbi.nlm.nih.gov/pmc/articles/PMC5379249PMC
March 2017

Multiplatform serum metabolic phenotyping combined with pathway mapping to identify biochemical differences in smokers.

Bioanalysis 2016 Oct 16;8(19):2023-43. Epub 2016 Sep 16.

British American Tobacco, Research & Development, Regents Park Road, Southampton, SO15 8TL, UK.

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http://dx.doi.org/10.4155/bio-2016-0108DOI Listing
October 2016

Application of CE-MS to a metabonomics study of human urine from cigarette smokers and non-smokers.

Bioanalysis 2014 Oct;6(20):2733-49

Metabometrix Ltd, Bioincubator, Prince Consort Road, South Kensington, London SW7 2BP, UK.

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http://dx.doi.org/10.4155/bio.14.136DOI Listing
October 2014

The urinary proteome and metabonome differ from normal in adults with mitochondrial disease.

Kidney Int 2015 Mar 10;87(3):610-22. Epub 2014 Sep 10.

Medical Research Council Centre for Neuromuscular Diseases, National Hospital for Neurology and Neurosurgery, University College London Institute of Neurology, London, UK.

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http://dx.doi.org/10.1038/ki.2014.297DOI Listing
March 2015

Precision high-throughput proton NMR spectroscopy of human urine, serum, and plasma for large-scale metabolic phenotyping.

Anal Chem 2014 Oct 16;86(19):9887-94. Epub 2014 Sep 16.

Division of Computational and Systems Medicine, Department of Surgery and Cancer, Imperial College London , Sir Alexander Fleming Building, South Kensington, London SW7 2AZ, United Kingdom.

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http://dx.doi.org/10.1021/ac5025039DOI Listing
October 2014

The emergent role of metabolic phenotyping in dynamic patient stratification.

Expert Opin Drug Metab Toxicol 2014 Jul 6;10(7):915-9. Epub 2014 Jun 6.

Imperial College London, Division of Computational and Systems Medicine, Department of Surgery and Cancer , South Kensington, London SW7 2AZ UK +44 20 7594 3194 ;

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http://dx.doi.org/10.1517/17425255.2014.922954DOI Listing
July 2014

Determination of the tautomeric equilibria of pyridoyl benzoyl β-diketones in the liquid and solid state through the use of deuterium isotope effects on (1)H and (13)C NMR chemical shifts and spin coupling constants.

Spectrochim Acta A Mol Biomol Spectrosc 2015 Feb 6;136 Pt A:107-12. Epub 2013 Sep 6.

Computational and Systems Medicine, Department of Surgery and Cancer, Imperial College London, Sir Alexander Fleming Building, South Kensington, London SW7 2AZ, UK.

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http://dx.doi.org/10.1016/j.saa.2013.08.117DOI Listing
February 2015

Statistical spectroscopic tools for biomarker discovery and systems medicine.

Anal Chem 2013 Jun 23;85(11):5297-303. Epub 2013 May 23.

Computational and Systems Medicine, Department of Surgery and Cancer, Faculty of Medicine, Imperial College London, Sir Alexander Fleming Building, South Kensington, London SW7 2AZ, UK.

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http://dx.doi.org/10.1021/ac4007254DOI Listing
June 2013

Development of quantitative structure-metabolism (QSMR) relationships for substituted anilines based on computational chemistry.

Xenobiotica 2013 Sep 6;43(9):792-802. Epub 2013 Feb 6.

Department of Surgery and Cancer, Faculty of Medicine, Biomolecular Medicine, Imperial College London, South Kensington SW7 2AZ, UK.

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http://dx.doi.org/10.3109/00498254.2013.767953DOI Listing
September 2013

Hyperspectral visualization of mass spectrometry imaging data.

Anal Chem 2013 Feb 15;85(3):1415-23. Epub 2013 Jan 15.

Biomolecular Medicine, Department of Surgery and Cancer, Imperial College London, South Kensington, London SW7 2AZ, United Kingdom.

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http://dx.doi.org/10.1021/ac302330aDOI Listing
February 2013

Metabolic phenotyping in clinical and surgical environments.

Nature 2012 Nov;491(7424):384-92

Department of Surgery and Cancer, Faculty of Medicine, Imperial College London, South Kensington, London SW7 2AZ, UK.

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http://www.nature.com/articles/nature11708
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http://dx.doi.org/10.1038/nature11708DOI Listing
November 2012

Subset optimization by reference matching (STORM): an optimized statistical approach for recovery of metabolic biomarker structural information from 1H NMR spectra of biofluids.

Anal Chem 2012 Dec 4;84(24):10694-701. Epub 2012 Dec 4.

Section of Biomolecular Medicine, Department of Surgery and Cancer, Faculty of Medicine, Imperial College, London SW7 2AZ, United Kingdom.

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http://dx.doi.org/10.1021/ac302360vDOI Listing
December 2012

Pharmacometabonomic characterization of xenobiotic and endogenous metabolic phenotypes that account for inter-individual variation in isoniazid-induced toxicological response.

J Proteome Res 2012 Sep 9;11(9):4630-42. Epub 2012 Aug 9.

Biomolecular Medicine, Department of Surgery and Cancer, Faculty of Medicine, Imperial College London, Sir Alexander Fleming Building, South Kensington, London SW7 2AZ, UK.

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http://dx.doi.org/10.1021/pr300430uDOI Listing
September 2012

Targeting the human genome-microbiome axis for drug discovery: inspirations from global systems biology and traditional Chinese medicine.

J Proteome Res 2012 Jul 5;11(7):3509-19. Epub 2012 Jun 5.

Shanghai Center for Systems Biomedicine, School of Life Sciences and Biotechnology, Shanghai Jiao Tong University, Shanghai 200240, China.

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http://dx.doi.org/10.1021/pr3001628DOI Listing
July 2012

Evaluation of high resolution magic-angle coil spinning NMR spectroscopy for metabolic profiling of nanoliter tissue biopsies.

Anal Chem 2012 Apr 5;84(8):3843-8. Epub 2012 Apr 5.

CEA Saclay, DSM, IRAMIS, UMR CEA/CNRS no 3299-SIS2M, Laboratoire Structure et Dynamique par Résonance Magnétique, Gif-sur-Yvette, France.

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http://pubs.acs.org/doi/10.1021/ac300153k
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http://dx.doi.org/10.1021/ac300153kDOI Listing
April 2012

Pharmacometabonomic investigation of dynamic metabolic phenotypes associated with variability in response to galactosamine hepatotoxicity.

J Proteome Res 2012 Apr 2;11(4):2427-40. Epub 2012 Mar 2.

Biomolecular Medicine, Department of Surgery and Cancer, Faculty of Medicine, Imperial College London, United Kingdom.

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http://pubs.acs.org/doi/10.1021/pr201161f
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http://dx.doi.org/10.1021/pr201161fDOI Listing
April 2012

Chiral metabonomics: 1H NMR-based enantiospecific differentiation of metabolites in human urine via direct cosolvation with β-cyclodextrin.

Anal Chem 2012 Mar 29;84(6):2868-74. Epub 2012 Feb 29.

Servei de Ressonància Magnètica Nuclear, Facultat de Ciències i Biociències, Universitat Autònoma de Barcelona, Bellaterra 08193, Spain.

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http://pubs.acs.org/doi/10.1021/ac203291d
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http://dx.doi.org/10.1021/ac203291dDOI Listing
March 2012

Omics and its potential impact on R&D and regulation of complex herbal products.

J Ethnopharmacol 2012 Apr 1;140(3):587-93. Epub 2012 Feb 1.

University of Oulu, Department of Pharmacology and Toxicology, 90014 Oulu, Finland.

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http://dx.doi.org/10.1016/j.jep.2012.01.035DOI Listing
April 2012

Intra- and interlaboratory reproducibility of ultra performance liquid chromatography-time-of-flight mass spectrometry for urinary metabolic profiling.

Anal Chem 2012 Mar 13;84(5):2424-32. Epub 2012 Feb 13.

Biomolecular Medicine, Department of Surgery and Cancer, Faculty of Medicine, Sir Alexander Fleming Building, Imperial College London, London, SW7 2AZ, U.K.

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http://dx.doi.org/10.1021/ac203200xDOI Listing
March 2012

Robust data processing and normalization strategy for MALDI mass spectrometric imaging.

Anal Chem 2012 Feb 10;84(3):1310-9. Epub 2012 Jan 10.

Biomolecular Medicine, Department of Surgery and Cancer, Faculty of Medicine, Imperial College London, Sir Alexander Fleming Building, South Kensington, London SW7 2AZ, United Kingdom.

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http://pubs.acs.org/doi/10.1021/ac201767g
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http://dx.doi.org/10.1021/ac201767gDOI Listing
February 2012

Statistical total correlation spectroscopy scaling for enhancement of metabolic information recovery in biological NMR spectra.

Anal Chem 2012 Jan 27;84(2):1083-91. Epub 2011 Dec 27.

Neuroscience Research Australia, Barker Street, Randwick 2031, Australia.

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http://pubs.acs.org/doi/10.1021/ac202720f
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http://dx.doi.org/10.1021/ac202720fDOI Listing
January 2012

Stability and robustness of human metabolic phenotypes in response to sequential food challenges.

J Proteome Res 2012 Feb 16;11(2):643-55. Epub 2011 Dec 16.

Biomolecular Medicine, Department of Surgery & Cancer, Imperial College London , Sir Alexander Fleming Building, South Kensington, London, SW7 2AZ, United Kingdom.

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http://pubs.acs.org/doi/10.1021/pr2005764
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http://dx.doi.org/10.1021/pr2005764DOI Listing
February 2012

Non-linear modeling of 1H NMR metabonomic data using kernel-based orthogonal projections to latent structures optimized by simulated annealing.

Anal Chim Acta 2011 Oct 20;705(1-2):72-80. Epub 2011 Apr 20.

Biomolecular Medicine, Department of Surgery and Cancer, Faculty of Medicine, Imperial College London, Sir Alexander Fleming Building, South Kensington, London SW7 2AZ, UK.

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http://dx.doi.org/10.1016/j.aca.2011.04.016DOI Listing
October 2011

Identification of human urinary biomarkers of cruciferous vegetable consumption by metabonomic profiling.

J Proteome Res 2011 Oct 31;10(10):4513-21. Epub 2011 Aug 31.

Biomolecular Medicine, Department of Surgery and Cancer, Faculty of Medicine, Imperial College London, South Kensington, London SW7 2AZ, United Kingdom.

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http://dx.doi.org/10.1021/pr200326kDOI Listing
October 2011

A metabolic system-wide characterisation of the pig: a model for human physiology.

Mol Biosyst 2011 Sep 14;7(9):2577-88. Epub 2011 Jul 14.

Biomolecular Medicine, Department of Surgery and Cancer, Imperial College London, UKSW7 2AZ.

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http://dx.doi.org/10.1039/c1mb05023kDOI Listing
September 2011

Bile UPLC-MS fingerprinting and bile acid fluxes during human liver transplantation.

Electrophoresis 2011 Aug 6;32(15):2063-70. Epub 2011 Jul 6.

Biomolecular Medicine, Department of Surgery and Cancer, Faculty of Medicine, Imperial College London, London, United Kingdom.

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http://dx.doi.org/10.1002/elps.201000512DOI Listing
August 2011

Data-driven approach for metabolite relationship recovery in biological 1H NMR data sets using iterative statistical total correlation spectroscopy.

Anal Chem 2011 Mar 16;83(6):2075-82. Epub 2011 Feb 16.

Biomolecular Medicine, Department of Surgery and Cancer, Faculty of Medicine, Imperial College London, Sir Alexander Fleming Building, South Kensington, SW7 2AZ, United Kingdom.

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http://dx.doi.org/10.1021/ac102870uDOI Listing
March 2011

Processing and modeling of nuclear magnetic resonance (NMR) metabolic profiles.

Methods Mol Biol 2011 ;708:365-88

Biomolecular Medicine, Department of Surgery and Cancer, Faculty of Medicine, Imperial College, London, UK.

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http://dx.doi.org/10.1007/978-1-61737-985-7_21DOI Listing
April 2011

Pharmacometabonomics as an effector for personalized medicine.

Pharmacogenomics 2011 Jan;12(1):103-11

Biomolecular Medicine, Department of Surgery & Cancer, Faculty of Medicine, Imperial College London, Sir Alexander Fleming Building, South Kensington, London, SW7 2AZ, UK.

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http://dx.doi.org/10.2217/pgs.10.157DOI Listing
January 2011

Synthesis of a series of phenylacetic acid 1-β-O-acyl glucosides and comparison of their acyl migration and hydrolysis kinetics with the corresponding acyl glucuronides.

Org Biomol Chem 2011 Feb 8;9(3):926-34. Epub 2010 Dec 8.

Department of Chemistry, The Robert Robinson Laboratories, University of Liverpool, Liverpool, UK L69 7ZD.

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http://xlink.rsc.org/?DOI=C0OB00820F
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http://dx.doi.org/10.1039/c0ob00820fDOI Listing
February 2011

HILIC-UPLC-MS for exploratory urinary metabolic profiling in toxicological studies.

Anal Chem 2011 Jan 13;83(1):382-90. Epub 2010 Dec 13.

Biomolecular Medicine, Department of Surgery and Cancer, Faculty of Medicine, Imperial College London, London SW7 2AZ, UK.

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http://dx.doi.org/10.1021/ac102523qDOI Listing
January 2011

Spectroscopic and statistical methods in metabonomics.

Bioanalysis 2009 Dec;1(9):1559-78

Metabometrix Ltd, Incubator, Prince Consort Road, London, SW7 2BP, UK.

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http://dx.doi.org/10.4155/bio.09.143DOI Listing
December 2009

High-resolution magic-angle-spinning NMR spectroscopy for metabolic profiling of intact tissues.

Nat Protoc 2010 Jun 13;5(6):1019-32. Epub 2010 May 13.

Biomolecular Medicine, Department of Surgery and Cancer, Faculty of Medicine, Imperial College London, South Kensington, London, UK.

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http://dx.doi.org/10.1038/nprot.2010.45DOI Listing
June 2010

A metabolic entropy approach for measurements of systemic metabolic disruptions in patho-physiological States.

J Proteome Res 2010 Jul;9(7):3537-44

Biomolecular Medicine, Department of Surgery and Cancer, Faculty of Medicine, Imperial College London, Sir Alexander Fleming Building, London SW7 2AZ, United Kingdom.

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http://dx.doi.org/10.1021/pr1000576DOI Listing
July 2010

Urinary metabolic phenotyping differentiates children with autism from their unaffected siblings and age-matched controls.

J Proteome Res 2010 Jun;9(6):2996-3004

Biomolecular Medicine, Division of Surgery and Cancer, Faculty of Medicine, Imperial College London, Sir Alexander Fleming Building, South Kensington Campus, London, United Kingdom.

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http://dx.doi.org/10.1021/pr901188eDOI Listing
June 2010

A statistically rigorous test for the identification of parent-fragment pairs in LC-MS datasets.

Anal Chem 2010 Mar;82(5):1766-78

Biomolecular Medicine, Department of Surgery & Cancer, Faculty of Medicine, Sir Alexander Fleming Building, Imperial College London, SW7 2AZ, United Kingdom.

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http://dx.doi.org/10.1021/ac902361fDOI Listing
http://www.ncbi.nlm.nih.gov/pmc/articles/PMC2829950PMC
March 2010

Evaluation of full-resolution J-resolved 1H NMR projections of biofluids for metabonomics information retrieval and biomarker identification.

Anal Chem 2010 Mar;82(5):1811-21

Biomolecular Medicine, Department of Surgery and Cancer, Faculty of Medicine, Imperial College London, Sir Alexander Fleming Building, South Kensington, London SW7 2AZ, United Kingdom.

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http://dx.doi.org/10.1021/ac902443kDOI Listing
March 2010

The influence of EDTA and citrate anticoagulant addition to human plasma on information recovery from NMR-based metabolic profiling studies.

Mol Biosyst 2010 Jan 28;6(1):215-24. Epub 2009 Sep 28.

Department of Biomolecular Medicine, Faculty of Medicine, Imperial College London, Sir Alexander Fleming Building, South Kensington, London, UK.

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http://dx.doi.org/10.1039/b907021dDOI Listing
January 2010

High-resolution 1H NMR spectroscopic investigation of a chick embryo model of neural tube development.

Magn Reson Chem 2009 Dec;47 Suppl 1:S62-7

Biomolecular Medicine, Department of Surgery and Cancer, Faculty of Medicine, Imperial College London, Sir Alexander Fleming Building, South Kensington, London, SW7 2AZ, UK.

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http://dx.doi.org/10.1002/mrc.2534DOI Listing
December 2009

Chemical shift calibration of 1H MAS NMR liver tissue spectra exemplified using a study of glycine protection of galactosamine toxicity.

Magn Reson Chem 2009 Dec;47 Suppl 1:S47-53

Biomolecular Medicine, Department of Surgery and Cancer, Faculty of Medicine, Imperial College London, South Kensington, London SW7 2AZ, UK.

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http://dx.doi.org/10.1002/mrc.2521DOI Listing
December 2009

Pharmacometabonomic identification of a significant host-microbiome metabolic interaction affecting human drug metabolism.

Proc Natl Acad Sci U S A 2009 Aug 10;106(34):14728-33. Epub 2009 Aug 10.

SORA Division, Faculty of Medicine, Sir Alexander Fleming Building, Imperial College London, South Kensington, London, United Kingdom.

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http://dx.doi.org/10.1073/pnas.0904489106DOI Listing
http://www.ncbi.nlm.nih.gov/pmc/articles/PMC2731842PMC
August 2009

Cluster analysis statistical spectroscopy using nuclear magnetic resonance generated metabolic data sets from perturbed biological systems.

Anal Chem 2009 Aug;81(16):6581-9

Biomolecular Medicine, Sir Alexander Fleming Building, Division of Surgery, Oncology, Reproductive Biology, and Anesthetics, Faculty of Medicine, Imperial College London, SW7 2AZ, United Kingdom.

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http://dx.doi.org/10.1021/ac901240jDOI Listing
August 2009

Statistical total correlation spectroscopy editing of 1H NMR spectra of biofluids: application to drug metabolite profile identification and enhanced information recovery.

Anal Chem 2009 Aug;81(15):6458-66

Department of Biomolecular Medicine, Sir Alexander Fleming Building, Division of Surgery, Oncology, Reproductive Biology and Anesthetics, Faculty of Medicine, Imperial College London, SW7 2AZ, United Kingdom.

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http://dx.doi.org/10.1021/ac900828pDOI Listing
August 2009

¹H NMR-based metabonomics for investigating diabetes.

Future Med Chem 2009 Jul;1(4):737-47

Division of Surgery, Oncology, Reproductive Biology and Anaesthetics, Department of Biomolecular Medicine, Faculty of Medicine, Imperial College London, South Kensington SW72AZ, UK.

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http://dx.doi.org/10.4155/fmc.09.54DOI Listing
July 2009

Synthesis, transacylation kinetics and computational chemistry of a set of arylacetic acid 1beta-O-acyl glucuronides.

Org Biomol Chem 2009 Jun 27;7(12):2525-33. Epub 2009 Apr 27.

Robert Robinson Laboratories, Department of Chemistry, University of Liverpool, Liverpool, UK L69 7ZD.

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http://dx.doi.org/10.1039/b822777bDOI Listing
June 2009

NMR-based metabolic profiling identifies biomarkers of liver regeneration following partial hepatectomy in the rat.

J Proteome Res 2010 Jan;9(1):59-69

Department of Biomolecular Medicine, Division of Surgery, Oncology, Reproductive Biology & Anaesthetics, Faculty of Medicine, Imperial College London, South Kensington, London SW7 2AZ, United Kingdom.

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http://dx.doi.org/10.1021/pr900200vDOI Listing
January 2010

Panorganismal gut microbiome-host metabolic crosstalk.

J Proteome Res 2009 Apr;8(4):2090-105

Department of Biomolecular Medicine, Division of Surgery, Oncology, Reproductive Biology and Anaesthetics, Faculty of Medicine, Imperial College London, Sir Alexander Fleming Building, South Kensington, London SW7 2AZ, United Kingdom.

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http://dx.doi.org/10.1021/pr801068xDOI Listing
April 2009

Dynamic biochemical information recovery in spontaneous human seminal fluid reactions via 1H NMR kinetic statistical total correlation spectroscopy.

Anal Chem 2009 Jan;81(1):288-95

Department of Biomolecular Medicine, Division of Surgery, Oncology, Reproductive Biology and Anaesthetics (SORA), Faculty of Medicine, Imperial College London, South Kensington, SW7 2AZ, United Kingdom.

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http://dx.doi.org/10.1021/ac801993mDOI Listing
January 2009

Recursive segment-wise peak alignment of biological (1)h NMR spectra for improved metabolic biomarker recovery.

Anal Chem 2009 Jan;81(1):56-66

Department of Biomolecular Medicine, Division of Surgery, Oncology, Reproductive Biology and Anesthetics (SORA), Faculty of Medicine, Imperial College London, Sir Alexander Fleming Building, London, UK.

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http://dx.doi.org/10.1021/ac8011544DOI Listing
January 2009

Genetic algorithms for simultaneous variable and sample selection in metabonomics.

Bioinformatics 2009 Jan 14;25(1):112-8. Epub 2008 Nov 14.

Department of Biomolecular Medicine, Division of Surgery, Oncology, Reproductive Biology and Anaesthetics, Faculty of Medicine, Imperial College London, Sir Alexander Fleming Building, South Kensington, London, SW7 2AZ, UK.

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http://dx.doi.org/10.1093/bioinformatics/btn586DOI Listing
January 2009

Systems biology: Metabonomics.

Nature 2008 Oct;455(7216):1054-6

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http://dx.doi.org/10.1038/4551054aDOI Listing
October 2008

Seminal oligouridinosis: low uridine secretion as a biomarker for infertility in spinal neurotrauma.

Clin Chem 2008 Dec 2;54(12):2063-6. Epub 2008 Oct 2.

Department of Biomolecular Medicine, SORA Division, Faculty of Medicine, Imperial College London, London, UK.

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http://dx.doi.org/10.1373/clinchem.2008.112219DOI Listing
December 2008

Optimization of human plasma 1H NMR spectroscopic data processing for high-throughput metabolic phenotyping studies and detection of insulin resistance related to type 2 diabetes.

Anal Chem 2008 Oct 30;80(19):7354-62. Epub 2008 Aug 30.

Department of Biomolecular Medicine, Division of Surgery, Oncology, Reproductive Biology and Anaesthetics, Faculty of Medicine, Imperial College London, South Kensington SW7 2AZ, United Kingdom.

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http://dx.doi.org/10.1021/ac801053gDOI Listing
October 2008

Temporal metabonomic modeling of l-arginine-induced exocrine pancreatitis.

J Proteome Res 2008 Oct 19;7(10):4435-45. Epub 2008 Aug 19.

Department of Pharmaceutical Chemistry, Semmelweis University, Hogyes Endre u. 9, Budapest 1092, Hungary.

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http://dx.doi.org/10.1021/pr800407jDOI Listing
October 2008

Robust algorithms for automated chemical shift calibration of 1D 1H NMR spectra of blood serum.

Anal Chem 2008 Sep 15;80(18):7158-62. Epub 2008 Aug 15.

Department of Biomolecular Medicine, Division of Surgery, Oncology, Reproductive Biology and Anaesthetics, Faculty of Medicine, Imperial College, London, SW7 2AZ, UK

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http://dx.doi.org/10.1021/ac8011494DOI Listing
September 2008

Spectroscopic and statistical techniques for information recovery in metabonomics and metabolomics.

Annu Rev Anal Chem (Palo Alto Calif) 2008 ;1:45-69

Department of Biomolecular Medicine, Imperial College London, United Kingdom.

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http://dx.doi.org/10.1146/annurev.anchem.1.031207.113026DOI Listing
October 2010

Self-modeling curve resolution recovery of temporal metabolite signal modulation in NMR spectroscopic data sets: application to a life-long caloric restriction study in dogs.

Anal Chem 2008 Jul 30;80(13):4876-85. Epub 2008 May 30.

Department of Biomolecular Medicine, SORA Division, Faculty of Medicine, Imperial College London, Sir Alexander Fleming Building, South Kensington London, SW7 2AZ, UK.

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http://dx.doi.org/10.1021/ac702584gDOI Listing
July 2008

Kinetic and J-resolved statistical total correlation NMR spectroscopy approaches to structural information recovery in complex reacting mixtures: application to acyl glucuronide intramolecular transacylation reactions.

Anal Chem 2008 Jul 10;80(13):4886-95. Epub 2008 May 10.

Department of Biomolecular Medicine, Division of Surgery, Oncology, Reproductive Biology and Anaesthetics, Faculty of Medicine, Sir Alexander Fleming Building, Imperial College London, South Kensington, London SW7 2AZ, UK.

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http://dx.doi.org/10.1021/ac702614tDOI Listing
July 2008

Application of the FLIPSY pulse sequence for increased sensitivity in 1H NMR-based metabolic profiling studies.

Anal Chem 2008 May 26;80(9):3365-71. Epub 2008 Mar 26.

Department of Pharmaceutics and Analytical Chemistry, Faculty of Pharmaceutical Sciences, University of Copenhagen, Denmark.

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http://dx.doi.org/10.1021/ac702563uDOI Listing
May 2008

Heteronuclear 19F-1H statistical total correlation spectroscopy as a tool in drug metabolism: study of flucloxacillin biotransformation.

Anal Chem 2008 Feb 23;80(4):1073-9. Epub 2008 Jan 23.

Department of Biomolecular Medicine, Division of Surgery, Oncology, Reproductive Biology and Anaesthetics, Faculty of Medicine, Imperial College London, South Kensington Campus, London SW7 2AZ, U.K.

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http://dx.doi.org/10.1021/ac702040dDOI Listing
February 2008

Magic angle spinning NMR and 1H-31P heteronuclear statistical total correlation spectroscopy of intact human gut biopsies.

Anal Chem 2008 Feb 19;80(4):1058-66. Epub 2008 Jan 19.

Department of Biomolecular Medicine, SORA Division, Faculty of Medicine, Imperial College London, Sir Alexander Fleming Building, South Kensington, London, UK.

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http://dx.doi.org/10.1021/ac701988aDOI Listing
February 2008

Probiotic modulation of symbiotic gut microbial-host metabolic interactions in a humanized microbiome mouse model.

Mol Syst Biol 2008 15;4:157. Epub 2008 Jan 15.

Department of Biomolecular Medicine, Division of Surgery, Oncology, Reproductive Biology and Anaesthetics, Faculty of Medicine, Imperial College London, London, UK.

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http://dx.doi.org/10.1038/msb4100190DOI Listing
http://www.ncbi.nlm.nih.gov/pmc/articles/PMC2238715PMC
January 2008

NMR-based metabolic profiling and metabonomic approaches to problems in molecular toxicology.

Chem Res Toxicol 2008 Jan 3;21(1):9-27. Epub 2008 Jan 3.

Department of Biomolecular Medicine, Surgery, Oncology, Reproductive Biology and Anesthetics Division, Faculty of Medicine, Imperial College London, London, UK.

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http://www.researchgate.net/profile/Jeremy_Nicholson2/public
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http://pubs.acs.org/doi/abs/10.1021/tx700335d
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http://dx.doi.org/10.1021/tx700335dDOI Listing
January 2008

Species variation in the fecal metabolome gives insight into differential gastrointestinal function.

J Proteome Res 2008 Jan 1;7(1):352-60. Epub 2007 Dec 1.

Department of Public Health and Epidemiology, Swiss Tropical Institute, P.O. Box, CH-4002 Basel, Switzerland.

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http://dx.doi.org/10.1021/pr070340kDOI Listing
January 2008