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John Lindon

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Judith M Fonville; Rian L Griffiths; Elaine Holmes; Patricia F Lalor; John C Lindon; Jeremy K Nicholson; Andrew D Palmer; Luis Pizarro; Rory T Steven; Claire L Carter; Josephine Bunch
Hyperspectral visualization of mass spectrometry imaging data.
G H Cantor; G L Cockerell; Timothy M D Ebbels; Elaine Holmes; Hector C Keun; John C Lindon; Henrik Antti; Olaf Beckonert; Roy H Bible; Mary E Bollard; Alan P Breau; J A Wijsman; Jeremy K Nicholson
Integrated histopathological and urinary metabonomic investigation of the pathogenesis of microcystin-LR toxicosis.
Joram M Posma; Maria De Iorio; Timothy M D Ebbels; Paul Elliott; Isabel Garcia Perez; Elaine Holmes; John C Lindon; Jeremy K Nicholson
Subset optimization by reference matching (STORM): an optimized statistical approach for recovery of metabolic biomarker structural information from 1H NMR spectra of biofluids.

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2013: Judith M Fonville; Rian L Griffiths; Elaine Holmes; Patricia F Lalor; John C Lindon; Jeremy K Nicholson; Andrew D Palmer; Luis Pizarro; Rory T Steven; Claire L Carter; Josephine Bunch
Hyperspectral visualization of mass spectrometry imaging data.
Analytical chemistry 2013;85(3):1415-23.
2013: G H Cantor; G L Cockerell; Timothy M D Ebbels; Elaine Holmes; Hector C Keun; John C Lindon; Henrik Antti; Olaf Beckonert; Roy H Bible; Mary E Bollard; Alan P Breau; J A Wijsman; Jeremy K Nicholson
Integrated histopathological and urinary metabonomic investigation of the pathogenesis of microcystin-LR toxicosis.
Veterinary pathology 2013;50(1):159-71.
2012: Joram M Posma; Maria De Iorio; Timothy M D Ebbels; Paul Elliott; Isabel Garcia Perez; Elaine Holmes; John C Lindon; Jeremy K Nicholson
Subset optimization by reference matching (STORM): an optimized statistical approach for recovery of metabolic biomarker structural information from 1H NMR spectra of biofluids.
Analytical chemistry 2012;84(24):10694-701.
2012: Jeremy K Nicholson; Zoltan Takats; Ara W Darzi; Elaine Holmes; James M Kinross; John C Lindon
Metabolic phenotyping in clinical and surgical environments.
Nature 2012;491(7424):384-92.
2012: Katharine Cunningham; Jeremy R Everett; Elaine Holmes; John C Lindon; Jeremy K Nicholson; Sandrine P Claus; Muireann Coen
Pharmacometabonomic characterization of xenobiotic and endogenous metabolic phenotypes that account for inter-individual variation in isoniazid-induced toxicological response.
Journal of proteome research 2012;11(9):4630-42.
2012: Liping Zhao; Elaine Holmes; Jia V Li; Aiping Lu; Jeremy K Nicholson; Jian Shen; Huiru Tang; Zhengtao Wang; Xu Zhang; John C Lindon
Targeting the human genome-microbiome axis for drug discovery: inspirations from global systems biology and traditional Chinese medicine.
Journal of proteome research 2012;11(7):3509-19.
2012: Alan Wong; Elaine Holmes; Beatriz Jiménez; Xiaonan Li; John C Lindon; Jeremy K Nicholson; Dimitris Sakellariou
Evaluation of high resolution magic-angle coil spinning NMR spectroscopy for metabolic profiling of nanoliter tissue biopsies.
Analytical chemistry 2012;84(8):3843-8.
2012: Olavi Pelkonen; Qihe Xu; Liping Zhao; Kelvin Chan; Greer Deal; John C Lindon; Markku Pasanen; Tai-Ping Fan
Omics and its potential impact on R&D and regulation of complex herbal products.
Journal of ethnopharmacology 2012;140(3):587-93.
2012: Muireann Coen; Françoise Goldfain-Blanc; Elaine Holmes; John C Lindon; Donald G Robertson; Gaëlle Rolland-Valognes; Bernard Walther; Jeremy K Nicholson
Pharmacometabonomic investigation of dynamic metabolic phenotypes associated with variability in response to galactosamine hepatotoxicity.
Journal of proteome research 2012;11(4):2427-40.
2012: Gonçalo Graça; John C Lindon; Cristina Pita; Konstantina Spagou; Kirill Veselkov; Elizabeth J Want; António S Barros; Isabel M Carreira; Sílvia Diaz; Iola F Duarte; Eulália Galhano; Brian Goodfellow; Ana M Gil
UPLC-MS metabolic profiling of second trimester amniotic fluid and maternal urine and comparison with NMR spectral profiling for the identification of pregnancy disorder biomarkers.
Molecular bioSystems 2012;8(4):1243-54.
2012: Miriam Perez-Trujillo; Hector C Keun; John C Lindon; Jeremy K Nicholson; Teodor Parella; Toby J Athersuch
Chiral metabonomics: 1H NMR-based enantiospecific differentiation of metabolites in human urine via direct cosolvation with β-cyclodextrin.
Analytical chemistry 2012;84(6):2868-74.
2012: H Paul Benton; Alexander Amberg; Francoise Goldfain-Blanc; Elaine Holmes; Hector C Keun; John C Lindon; Jeremy K Nicholson; Robert S Plumb; Michael D Reily; Bernhard Walther; Elizabeth Want; Timothy M D Ebbels
Intra- and interlaboratory reproducibility of ultra performance liquid chromatography-time-of-flight mass spectrometry for urinary metabolic profiling.
Analytical chemistry 2012;84(5):2424-32.
2012: Judith M Fonville; Josephine Bunch; Claire Carter; Olivier Cloarec; John C Lindon; Jeremy K Nicholson; Elaine Holmes
Robust data processing and normalization strategy for MALDI mass spectrometric imaging.
Analytical chemistry 2012;84(3):1310-9.
2012: Jean-Baptiste Cazier; Marc-Emmanuel Dumas; Timothy M D Ebbels; Karène Argoud; Marie-Thérèse Bihoreau; Benjamin J Blaise; Elaine C Holmes; Pamela J Kaisaki; John C Lindon; Steve C Mitchell; Jeremy K Nicholson; James Scott; Tsz Tsang; Kirill Veselkov; Yulan Wang; Dominique Gauguier
Untargeted metabolome quantitative trait locus mapping associates variation in urine glycerate to mutant glycerate kinase.
Journal of proteome research 2012;11(2):631-42.
2012: Silke S Heinzmann; Elaine Holmes; Sunil Kochhar; John C Lindon; Claire A Merrifield; Francois-Pierre Martin; Jeremy K Nicholson
Stability and robustness of human metabolic phenotypes in response to sequential food challenges.
Journal of proteome research 2012;11(2):643-55.
2012: Jeremy K Nicholson; Jeremy R Everett; John C Lindon
Longitudinal pharmacometabonomics for predicting patient responses to therapy: drug metabolism, toxicity and efficacy.
Expert opinion on drug metabolism & toxicology 2012;8(2):135-9.
2012: Anthony D Maher; Muireann Coen; Judith M Fonville; John C Lindon; Caroline D Rae; Jeremy K Nicholson
Statistical total correlation spectroscopy scaling for enhancement of metabolic information recovery in biological NMR spectra.
Analytical chemistry 2012;84(2):1083-91.
2011: Judith M Fonville; Elaine Holmes; John C Lindon; Jeremy K Nicholson; Max Bylesjö; Muireann Coen; Mattias Rantalainen
Non-linear modeling of 1H NMR metabonomic data using kernel-based orthogonal projections to latent structures optimized by simulated annealing.
Analytica chimica acta 2011;705(1-2):72-80.
2011: William M B Edmands; Olaf Beckonert; Alison Campbell; Elaine Holmes; Brian G Lake; John C Lindon; Cinzia Stella; Nigel J Gooderham
Identification of human urinary biomarkers of cruciferous vegetable consumption by metabonomic profiling.
Journal of proteome research 2011;10(10):4513-21.
2011: George Nicholson; Jeremy K Nicholson; Mattias Rantalainen; N William Rayner; Ugis Sarkans; Tim D Spector; Karsten Suhre; Henrik Toft; Juris Viksna; Krina T Zondervan; Jerzy Adamski; Kourosh R Ahmadi; Maxine Allen; Amy Barrett; Dorrit Baunsgaard; Peter Donnelly; Marc-Emmanuel Dumas; Johan H Faber; Elaine Holmes; Thomas Illig; Maria Krestyaninova; Jia V Li; John C Lindon; Anthony D Maher; Daniel Malmodin; Mark I McCarthy; Josine L Min; Sudeshna Guha Neogi; Chris C Holmes
A genome-wide metabolic QTL analysis in Europeans implicates two loci shaped by recent positive selection.
PLoS genetics 2011;7(9):e1002270.
2011: Claire A Merrifield; Francois-Pierre Martin; Mick Bailey; Olaf P Beckonert; Sandrine P Claus; Marc-Emmanuel Dumas; Swantje Duncker; Elaine Holmes; Sunil Kochhar; Marie Lewis; John C Lindon; Jeremy K Nicholson
A metabolic system-wide characterisation of the pig: a model for human physiology.
Molecular bioSystems 2011;7(9):2577-88.
2011: Cristina Legido-Quigley; John C Lindon; Lindsay McDermott; Gerard M Murphy; Jeremy K Nicholson; Hector Vilca-Melendez; Nigel Heaton; Elaine Holmes
Bile UPLC-MS fingerprinting and bile acid fluxes during human liver transplantation.
Electrophoresis 2011;32(15):2063-70.
2011: Kirill A Veselkov; Lisa K Vingara; Bernard Walther; Elizabeth Want; István Pelczer; Steven L Robinette; Richard H Barton; Claire Boursier-Neyret; Timothy M D Ebbels; Elaine Holmes; Jia V Li; John C Lindon; Perrine Masson; Jeremy K Nicholson
Optimized preprocessing of ultra-performance liquid chromatography/mass spectrometry urinary metabolic profiles for improved information recovery.
Analytical chemistry 2011;83(15):5864-72.
2011: Caroline J Sands; Muireann Coen; Timothy M D Ebbels; Elaine Holmes; John C Lindon; Jeremy K Nicholson
Data-driven approach for metabolite relationship recovery in biological 1H NMR data sets using iterative statistical total correlation spectroscopy.
Analytical chemistry 2011;83(6):2075-82.
2011: Lisa Iddon; Selena E Richards; Caroline Johnson; John R Harding; Ian D Wilson; Jeremy K Nicholson; John C Lindon; Andrew V Stachulski
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.
Organic & biomolecular chemistry 2011;9(3):926-34.
2011: Petia Shipkova; Jeffrey Vassallo; Nelly Aranibar; Serhiy Hnatyshyn; Haiying Zhang; T Andrew Clayton; Glenn H Cantor; Mark Sanders; Muireann Coen; John C Lindon; Elaine Holmes; Jeremy K Nicholson; Lois Lehman-McKeeman
Urinary metabolites of 2-bromoethanamine identified by stable isotope labelling: evidence for carbamoylation and glutathione conjugation.
Xenobiotica; the fate of foreign compounds in biological systems 2011;41(2):144-54.
2011: George Nicholson; Jeremy K Nicholson; Mattias Rantalainen; Ugis Sarkans; Bernard W Silverman; Tim D Spector; Henrik Toft; Juris Viksna; Krina T Zondervan; Kourosh R Ahmadi; Maxine Allen; Amy Barrett; Dorrit Baunsgaard; Peter Donnelly; Marc-Emmanuel Dumas; Johan H Faber; Ingileif B Hallgrímsdóttir; Elaine Holmes; Maria Krestyaninova; Jia V Li; John C Lindon; Anthony D Maher; Daniel Malmodin; Mark I McCarthy; Sudeshna Guha Neogi; Chris C Holmes
Human metabolic profiles are stably controlled by genetic and environmental variation.
Molecular systems biology 2011;7():525.
2011: Sandrine P Claus; Sandrine L Ellero; Bernard Berger; Lutz Krause; Anne Bruttin; Jérôme Molina; Alain Paris; Elizabeth J Want; Isabelle de Waziers; Olivier Cloarec; Selena E Richards; Yulan Wang; Marc-Emmanuel Dumas; Alastair Ross; Francois-Pierre Martin; Sunil Kochhar; Peter Van Bladeren; John C Lindon; Elaine Holmes; Jeremy K Nicholson
Colonization-induced host-gut microbial metabolic interaction.
mBio 2011;2(2):e00271-10.
2011: Timothy M D Ebbels; John C Lindon; Muireann Coen
Processing and modeling of nuclear magnetic resonance (NMR) metabolic profiles.
Methods in molecular biology (Clifton, N.J.) 2011;708():365-88.
2011: Jeremy K Nicholson; Ian D Wilson; John C Lindon
Pharmacometabonomics as an effector for personalized medicine.
Pharmacogenomics 2011;12(1):103-11.
2011: Konstantina Spagou; Ian D Wilson; Perrine Masson; Georgios Theodoridis; Nikolaos Raikos; Muireann Coen; Elaine Holmes; John C Lindon; Robert S Plumb; Jeremy K Nicholson; Elizabeth J Want
HILIC-UPLC-MS for exploratory urinary metabolic profiling in toxicological studies.
Analytical chemistry 2011;83(1):382-90.
2010: Elin S Karlsson; Caroline Johnson; Sunil Sarda; Lisa Iddon; Mazhar Iqbal; Xiaoli Meng; John R Harding; Andrew V Stachulski; Jeremy K Nicholson; Ian D Wilson; John C Lindon
High-performance liquid chromatography/mass spectrometric and proton nuclear magnetic resonance spectroscopic studies of the transacylation and hydrolysis of the acyl glucuronides of a series of phenylacetic acids in buffer and human plasma.
Rapid communications in mass spectrometry : RCM 2010;24(20):3043-51.
2010: Michael B Lauridsen; Henning Bliddal; Robin Christensen; Bente Danneskiold-Samsøe; Robert M Bennett; Hector Keun; John C Lindon; Jeremy K Nicholson; Mikkel H Dorff; Jerzy W Jaroszewski; Steen H Hansen; Claus Cornett
1H NMR spectroscopy-based interventional metabolic phenotyping: a cohort study of rheumatoid arthritis patients.
Journal of proteome research 2010;9(9):4545-53.
2010: Kirill A Veselkov; Valeriy I Pahomov; John C Lindon; Vladimir S Volynkin; Derek Crockford; George S Osipenko; David B Davies; Richard H Barton; Jung-Wook Bang; Elaine Holmes; Jeremy K Nicholson
A metabolic entropy approach for measurements of systemic metabolic disruptions in patho-physiological States.
Journal of proteome research 2010;9(7):3537-44.
2010: Cristina Legido-Quigley; Cinzia Stella; Francisco Perez-Jimenez; Jose Lopez-Miranda; Jose Ordovas; Jonathan Powell; Frans van der Ouderaa; Lisa Ware; John C Lindon; Jeremy K Nicholson; Elaine Holmes
Liquid chromatography-mass spectrometry methods for urinary biomarker detection in metabonomic studies with application to nutritional studies.
Biomedical chromatography : BMC 2010;24(7):737-43.
2010: Elizabeth J Want; Muireann Coen; Perrine Masson; Hector C Keun; Jake T M Pearce; Michael D Reily; Donald G Robertson; Cynthia M Rohde; Elaine Holmes; John C Lindon; Robert S Plumb; Jeremy K Nicholson
Ultra performance liquid chromatography-mass spectrometry profiling of bile acid metabolites in biofluids: application to experimental toxicology studies.
Analytical chemistry 2010;82(12):5282-9.
2010: Ivan K S Yap; Manya Angley; Kirill A Veselkov; Elaine Holmes; John C Lindon; Jeremy K Nicholson
Urinary metabolic phenotyping differentiates children with autism from their unaffected siblings and age-matched controls.
Journal of proteome research 2010;9(6):2996-3004.
2010: Olaf Beckonert; Muireann Coen; Hector C Keun; Yulan Wang; Timothy M D Ebbels; Elaine Holmes; John C Lindon; Jeremy K Nicholson
High-resolution magic-angle-spinning NMR spectroscopy for metabolic profiling of intact tissues.
Nature protocols 2010;5(6):1019-32.
2010: Andreas Ipsen; Elizabeth J Want; John C Lindon; Timothy M D Ebbels
A statistically rigorous test for the identification of parent-fragment pairs in LC-MS datasets.
Analytical chemistry 2010;82(5):1766-78.
2010: Judith M Fonville; Anthony D Maher; Muireann Coen; Elaine Holmes; John C Lindon; Jeremy K Nicholson
Evaluation of full-resolution J-resolved 1H NMR projections of biofluids for metabonomics information retrieval and biomarker identification.
Analytical chemistry 2010;82(5):1811-21.
2010: Richard H Barton; Daniel Waterman; Frank W Bonner; Elaine Holmes; Robert Clarke; Jeremy K Nicholson; John C Lindon
The influence of EDTA and citrate anticoagulant addition to human plasma on information recovery from NMR-based metabolic profiling studies.
Molecular bioSystems 2010;6(1):215-24.
2010: Caroline Johnson; E Karlsson; S Sarda; L Iddon; Mazhar Iqbal; X Meng; John R Harding; Andrew V Stachulski; Jeremy K Nicholson; Ian D Wilson; John C Lindon
Integrated HPLC-MS and (1)H-NMR spectroscopic studies on acyl migration reaction kinetics of model drug ester glucuronides.
Xenobiotica; the fate of foreign compounds in biological systems 2010;40(1):9-23.
2010: Mary E Bollard; Nancy R Contel; Timothy M D Ebbels; Leon Smith; Olaf Beckonert; Glenn H Cantor; Lois D Lehman-McKeeman; Elaine C Holmes; John C Lindon; Jeremy K Nicholson; Hector C Keun
NMR-based metabolic profiling identifies biomarkers of liver regeneration following partial hepatectomy in the rat.
Journal of proteome research 2010;9(1):59-69.
2009: Daniel S Waterman; Frank W Bonner; John C Lindon
Spectroscopic and statistical methods in metabonomics.
Bioanalysis 2009;1(9):1559-78.
2009: Cristina Legido-Quigley; Olivier Cloarec; David A Parker; Gerard M Murphy; Elaine Holmes; John C Lindon; Jeremy K Nicholson; Ragai R Mitry; Hector Vilca-Melendez; Mohamed Rela; Anil Dhawan; Nigel Heaton
First example of hepatocyte transplantation to alleviate ornithine transcarbamylase deficiency, monitored by NMR-based metabonomics.
Bioanalysis 2009;1(9):1527-35.
2009: Muireann Coen; Ron A Wevers; John C Lindon; Henk J Blom
High-resolution 1H NMR spectroscopic investigation of a chick embryo model of neural tube development.
Magnetic resonance in chemistry : MRC 2009;47 Suppl 1():S62-7.
2009: Young-Shick Hong; Muireann Coen; Cynthia M Rhode; Michael D Reily; Donald G Robertson; Elaine Holmes; John C Lindon; Jeremy K Nicholson
Chemical shift calibration of 1H MAS NMR liver tissue spectra exemplified using a study of glycine protection of galactosamine toxicity.
Magnetic resonance in chemistry : MRC 2009;47 Suppl 1():S47-53.
2009: Eszter Bohus; Ákos Rácz; Béla Noszál; Muireann Coen; Olaf Beckonert; Hector C Keun; Timothy M D Ebbels; Glenn H Cantor; John A Wijsman; Elaine Holmes; John C Lindon; Jeremy K Nicholson
Metabonomic investigations into the global biochemical sequelae of exposure to the pancreatic toxin 1-cyano-2-hydroxy-3-butene in the rat.
Magnetic resonance in chemistry : MRC 2009;47 Suppl 1():S26-35.
2009: Muireann Coen; Elizabeth J Want; T Andrew Clayton; Cynthia M Rhode; Young-Shick Hong; Hector C Keun; Glenn H Cantor; Alan L Metz; Donald G Robertson; Michael D Reily; Elaine Holmes; John C Lindon; Jeremy K Nicholson
Mechanistic aspects and novel biomarkers of responder and non-responder phenotypes in galactosamine-induced hepatitis.
Journal of proteome research 2009;8(11):5175-87.
2009: T Andrew Clayton; David Baker; John C Lindon; Jeremy R Everett; Jeremy K Nicholson
Pharmacometabonomic identification of a significant host-microbiome metabolic interaction affecting human drug metabolism.
Proceedings of the National Academy of Sciences of the United States of America 2009;106(34):14728-33.
2009: Steven L Robinette; Kirill A Veselkov; Eszter Bohus; Muireann Coen; Hector C Keun; Timothy M D Ebbels; Olaf Beckonert; Elaine C Holmes; John C Lindon; Jeremy K Nicholson
Cluster analysis statistical spectroscopy using nuclear magnetic resonance generated metabolic data sets from perturbed biological systems.
Analytical chemistry 2009;81(16):6581-9.
2009: Caroline J Sands; Muireann Coen; Anthony D Maher; Timothy M D Ebbels; Elaine Holmes; John C Lindon; Jeremy K Nicholson
Statistical total correlation spectroscopy editing of 1H NMR spectra of biofluids: application to drug metabolite profile identification and enhanced information recovery.
Analytical chemistry 2009;81(15):6458-66.
2009: Anthony D Maher; John C Lindon; Jeremy K Nicholson
¹H NMR-based metabonomics for investigating diabetes.
Future medicinal chemistry 2009;1(4):737-47.
2009: MA Warne; Jeremy K Nicholson; John C Lindon; P D Guiney; K P R Gartland
A QSAR investigation of dermal and respiratory chemical sensitizers based on computational chemistry properties.
SAR and QSAR in environmental research 2009;20(5-6):429-51.
2009: Francois-Pierre J Martin; Yulan Wang; Ivan K S Yap; Norbert Sprenger; John C Lindon; Francois-Pierre Martin; Sunil Kochhar; Elaine Holmes; Jeremy K Nicholson
Topographical variation in murine intestinal metabolic profiles in relation to microbiome speciation and functional ecological activity.
Journal of proteome research 2009;8(7):3464-74.
2009: Neil G Berry; Lisa Iddon; Mazhar Iqbal; Xiaoli Meng; Prabha Jayapal; Caroline Johnson; Jeremy K Nicholson; John C Lindon; John R Harding; Ian D Wilson; Andrew V Stachulski
Synthesis, transacylation kinetics and computational chemistry of a set of arylacetic acid 1beta-O-acyl glucuronides.
Organic & biomolecular chemistry 2009;7(12):2525-33.
2009: Leon M Smith; Anthony D Maher; Elizabeth J Want; Paul Elliott; Jeremiah Stamler; Geoffrey E Hawkes; Elaine Holmes; John C Lindon; Jeremy K Nicholson
Large-scale human metabolic phenotyping and molecular epidemiological studies via 1H NMR spectroscopy of urine: investigation of borate preservation.
Analytical chemistry 2009;81(12):4847-56.
2009: Francois-Pierre J Martin; norbert sprenger; Ivan K S Yap; Yulan Wang; Rodrigo Bibiloni; Florence Rochat; Francois-Pierre Martin; Christine Cherbut; Sunil Kochhar; John C Lindon; Elaine Holmes; Jeremy K Nicholson
Panorganismal gut microbiome-host metabolic crosstalk.
Journal of proteome research 2009;8(4):2090-105.
2009: Iola F Duarte; Cristina Legido-Quigley; David A Parker; Jonathan R Swann; Manfred Spraul; Ulrich Braumann; Ana M Gil; Elaine Holmes; Jeremy K Nicholson; Gerard M Murphy; Hector Vilca-Melendez; Nigel Heaton; John C Lindon
Identification of metabolites in human hepatic bile using 800 MHz 1H NMR spectroscopy, HPLC-NMR/MS and UPLC-MS.
Molecular bioSystems 2009;5(2):180-90.
2009: Anthony D Maher; Olivier Cloarec; Prasad Patki; Michael Craggs; Elaine Holmes; John C Lindon; Jeremy K Nicholson
Dynamic biochemical information recovery in spontaneous human seminal fluid reactions via 1H NMR kinetic statistical total correlation spectroscopy.
Analytical chemistry 2009;81(1):288-95.
2009: Kirill A Veselkov; John C Lindon; Timothy M D Ebbels; Derek J Crockford; Vladimir V Volynkin; Elaine Holmes; David B Davies; Jeremy K Nicholson
Recursive segment-wise peak alignment of biological (1)h NMR spectra for improved metabolic biomarker recovery.
Analytical chemistry 2009;81(1):56-66.
2008: Anthony D Maher; Prasad Patki; John C Lindon; Elizabeth J Want; Elaine Holmes; Michael Craggs; Jeremy K Nicholson
Seminal oligouridinosis: low uridine secretion as a biomarker for infertility in spinal neurotrauma.
Clinical chemistry 2008;54(12):2063-6.
2008: Jeremy K Nicholson; John C Lindon
Systems biology: Metabonomics.
Nature 2008;455(7216):1054-6.
2008: Anthony D Maher; Derek J Crockford; Henrik Toft; Daniel Malmodin; Johan Faber; Mark I McCarthy; Amy Barrett; Maxine Allen; Mark Walker; Elaine Holmes; John C Lindon; Jeremy K Nicholson
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.
Analytical chemistry 2008;80(19):7354-62.
2008: Eszter Bohus; Muireann Coen; Hector C Keun; Timothy M D Ebbels; Olaf Beckonert; John C Lindon; Elaine Holmes; Béla Noszál; Jeremy K Nicholson
Temporal metabonomic modeling of l-arginine-induced exocrine pancreatitis.
Journal of proteome research 2008;7(10):4435-45.
2008: Jake T M Pearce; Toby J Athersuch; Timothy M D Ebbels; John C Lindon; Jeremy K Nicholson; Hector C Keun
Robust algorithms for automated chemical shift calibration of 1D 1H NMR spectra of blood serum.
Analytical chemistry 2008;80(18):7158-62.
2008: Selena E Richards; Yulan Wang; Dennis Lawler; Sunil Kochhar; Elaine Holmes; John C Lindon; Jeremy K Nicholson
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.
Analytical chemistry 2008;80(13):4876-85.
2008: Caroline Johnson; Toby J Athersuch; Ian D Wilson; Lisa Iddon; Xiaoli Meng; Andrew V Stachulski; John C Lindon; Jeremy K Nicholson
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.
Analytical chemistry 2008;80(13):4886-95.
2008: Michael Lauridsen; Anthony D Maher; Hector Keun; John C Lindon; Jeremy K Nicholson; Nils T Nyberg; Steen H Hansen; Claus Cornett; Jerzy W Jaroszewski
Application of the FLIPSY pulse sequence for increased sensitivity in 1H NMR-based metabolic profiling studies.
Analytical chemistry 2008;80(9):3365-71.
2008: Hector C Keun; Toby J Athersuch; Olaf Beckonert; Yulan Wang; Jasmina Saric; John P Shockcor; John C Lindon; Ian D Wilson; Elaine Holmes; Jeremy K Nicholson
Heteronuclear 19F-1H statistical total correlation spectroscopy as a tool in drug metabolism: study of flucloxacillin biotransformation.
Analytical chemistry 2008;80(4):1073-9.
2008: Yulan Wang; Olivier Cloarec; Huiru Tang; John C Lindon; Elaine Holmes; Sunil Kochhar; Jeremy K Nicholson
Magic angle spinning NMR and 1H-31P heteronuclear statistical total correlation spectroscopy of intact human gut biopsies.
Analytical chemistry 2008;80(4):1058-66.
2008: John C Lindon; Jeremy K Nicholson
Spectroscopic and statistical techniques for information recovery in metabonomics and metabolomics.
Annual review of analytical chemistry (Palo Alto, Calif.) 2008;1():45-69.
2008: Francois-Pierre Martin; Yulan Wang; norbert sprenger; Ivan K S Yap; Serge Rezzi; Ziad Ramadan; Emma Peré-Trepat; Florence Rochat; Christine Cherbut; Peter van Bladeren; Laurent B Fay; Sunil Kochhar; John C Lindon; Elaine Holmes; Jeremy K Nicholson
Top-down systems biology integration of conditional prebiotic modulated transgenomic interactions in a humanized microbiome mouse model.
Molecular systems biology 2008;4():205.
2008: Francois-Pierre Martin; Yulan Wang; norbert sprenger; Ivan K S Yap; Torbjörn Lundstedt; Per Lek; Serge Rezzi; Ziad Ramadan; Peter van Bladeren; Laurent B Fay; Sunil Kochhar; John C Lindon; Elaine Holmes; Jeremy K Nicholson
Probiotic modulation of symbiotic gut microbial-host metabolic interactions in a humanized microbiome mouse model.
Molecular systems biology 2008;4():157.
2008: Muireann Coen; Elaine Holmes; John C Lindon; Jeremy K Nicholson
NMR-based metabolic profiling and metabonomic approaches to problems in molecular toxicology.
Chemical research in toxicology 2008;21(1):9-27.
2008: Jasmina Saric; Yulan Wang; Jia Li; Muireann Coen; Jürg Utzinger; Julian R Marchesi; Jennifer Keiser; Kirill Veselkov; John C Lindon; Jeremy K Nicholson; Elaine Holmes
Species variation in the fecal metabolome gives insight into differential gastrointestinal function.
Journal of proteome research 2008;7(1):352-60.
2007: C J Duckett; Ian D Wilson; D S Douce; H J Walker; Fadi Abou-Shakra; John C Lindon; Jeremy K Nicholson
Metabolism of 2-fluoro-4-iodoaniline in earthworm Eisenia veneta using (19)F-NMR spectroscopy, HPLC-MS, and HPLC-ICPMS ((127)I).
Xenobiotica; the fate of foreign compounds in biological systems 2007;37(12):1378-93.
2007: Muireann Coen; Young-Shick Hong; Olivier Cloarec; Cindy M Rhode; Michael D Reily; Donald G Robertson; Elaine Holmes; John C Lindon; Jeremy K Nicholson
Heteronuclear 1H-31P statistical total correlation NMR spectroscopy of intact liver for metabolic biomarker assignment: application to galactosamine-induced hepatotoxicity.
Analytical chemistry 2007;79(23):8956-66.
2007: Caroline Johnson; Ian D Wilson; John R Harding; Andrew V Stachulski; Lisa Iddon; Jeremy K Nicholson; John C Lindon
NMR spectroscopic studies on the in vitro acyl glucuronide migration kinetics of Ibuprofen ((+/-)-(R,S)-2-(4-isobutylphenyl) propanoic acid), its metabolites, and analogues.
Analytical chemistry 2007;79(22):8720-7.
2007: Serge Rezzi; Ziad Ramadan; Francois-Pierre Martin; Laurent B Fay; Peter van Bladeren; John C Lindon; Jeremy K Nicholson; Sunil Kochhar
Human metabolic phenotypes link directly to specific dietary preferences in healthy individuals.
Journal of proteome research 2007;6(11):4469-77.
2007: Timothy M D Ebbels; Hector C Keun; Olaf Beckonert; Mary E Bollard; John C Lindon; Elaine Holmes; Jeremy K Nicholson
Prediction and classification of drug toxicity using probabilistic modeling of temporal metabolic data: the consortium on metabonomic toxicology screening approach.
Journal of proteome research 2007;6(11):4407-22.
2007: Jia Li; Yulan Wang; Alan Fenwick; T Andrew Clayton; Yu Y K Lau; Cristina Legido-Quigley; John C Lindon; Jürg Utzinger; Elaine Holmes
A high-performance liquid chromatography and nuclear magnetic resonance spectroscopy-based analysis of commercially available praziquantel tablets.
Journal of pharmaceutical and biomedical analysis 2007;45(2):263-7.
2007: Yulan Wang; Elaine Holmes; Elena M Comelli; Grigorios Fotopoulos; Gian Dorta; Huiru Tang; Mattias Rantalainen; John C Lindon; Irène Corthésy-Theulaz; Laurent B Fay; Sunil Kochhar; Jeremy K Nicholson
Topographical variation in metabolic signatures of human gastrointestinal biopsies revealed by high-resolution magic-angle spinning 1H NMR spectroscopy.
Journal of proteome research 2007;6(10):3944-51.
2007: Leon M Smith; Anthony D Maher; Olivier Cloarec; Mattias Rantalainen; Huiru Tang; Paul Elliott; Jeremiah Stamler; John C Lindon; Elaine Holmes; Jeremy K Nicholson
Statistical correlation and projection methods for improved information recovery from diffusion-edited NMR spectra of biological samples.
Analytical chemistry 2007;79(15):5682-9.
2007: Muireann Coen; Young-Shick Hong; T Andrew Clayton; C M Rohde; J T Pearce; Michael D Reily; Donald G Robertson; Elaine Holmes; John C Lindon; Jeremy K Nicholson
The mechanism of galactosamine toxicity revisited; a metabonomic study.
Journal of proteome research 2007;6(7):2711-9.
2007: Claire R Teague; Firdaus S Dhabhar; Richard H Barton; Bridgette M Beckwith-Hall; Jonathan Powell; Mark Cobain; Burton Singer; Bruce McEwen; John C Lindon; Jeremy K Nicholson; Elaine Holmes
Metabonomic studies on the physiological effects of acute and chronic psychological stress in Sprague-Dawley rats.
Journal of proteome research 2007;6(6):2080-93.
2007: Elaine Holmes; Ruey Leng Loo; Olivier Cloarec; Muireann Coen; Huiru Tang; Elaine Maibaum; Stephen Bruce; Queenie Chan; Paul Elliott; Jeremiah Stamler; Ian D Wilson; John C Lindon; Jeremy K Nicholson
Detection of urinary drug metabolite (xenometabolome) signatures in molecular epidemiology studies via statistical total correlation (NMR) spectroscopy.
Analytical chemistry 2007;79(7):2629-40.
2007: Francois-Pierre Martin; Yulan Wang; norbert sprenger; Elaine Holmes; John C Lindon; Sunil Kochhar; Jeremy K Nicholson
Effects of probiotic Lactobacillus paracasei treatment on the host gut tissue metabolic profiles probed via magic-angle-spinning NMR spectroscopy.
Journal of proteome research 2007;6(4):1471-81.
2007: John C Lindon; Elaine Holmes; Jeremy K Nicholson
Metabonomics in pharmaceutical R&D.
The FEBS journal 2007;274(5):1140-51.
2007: T Andrew Clayton; John C Lindon; Jeremy R Everett; Claude Charuel; Gilles Hanton; Jean-Loic Le Net; Jean-Pierre Provost; Jeremy K Nicholson
Hepatotoxin-induced hypertyrosinemia and its toxicological significance.
Archives of toxicology 2007;81(3):201-10.
2007: Olaf Beckonert; Hector C Keun; Timothy M D Ebbels; Jacob G Bundy; Elaine Holmes; John C Lindon; Jeremy K Nicholson
Metabolic profiling, metabolomic and metabonomic procedures for NMR spectroscopy of urine, plasma, serum and tissue extracts.
Nature protocols 2007;2(11):2692-703.
2007: Francois-Pierre Martin; Marc-Emmanuel Dumas; Yulan Wang; Cristina Legido-Quigley; Ivan K S Yap; Huiru Tang; Séverine Zirah; Gerard M Murphy; Olivier Cloarec; John C Lindon; norbert sprenger; Laurent B Fay; Sunil Kochhar; Peter van Bladeren; Elaine Holmes; Jeremy K Nicholson
A top-down systems biology view of microbiome-mammalian metabolic interactions in a mouse model.
Molecular systems biology 2007;3():112.
2006: Andrew V Stachulski; John R Harding; John C Lindon; James L Maggs; B Kevin Park; Ian D Wilson
Acyl glucuronides: biological activity, chemical reactivity, and chemical synthesis.
Journal of medicinal chemistry 2006;49(24):6931-45.
2006: Cinzia Stella; Bridgette M Beckwith-Hall; Olivier Cloarec; Elaine Holmes; John C Lindon; Jonathan Powell; Frans van der Ouderaa; Sheila Bingham; Amanda J Cross; Jeremy K Nicholson
Susceptibility of human metabolic phenotypes to dietary modulation.
Journal of proteome research 2006;5(10):2780-8.
2006: Ivan K S Yap; T Andrew Clayton; Huiru Tang; Jeremy R Everett; Gilles Hanton; Jean-Pierre Provost; Jean-Loic Le Net; Claude Charuel; John C Lindon; Jeremy K Nicholson
An integrated metabonomic approach to describe temporal metabolic disregulation induced in the rat by the model hepatotoxin allyl formate.
Journal of proteome research 2006;5(10):2675-84.
2006: Francois-Pierre Martin; Elena F Verdu; Yulan Wang; Marc-Emmanuel Dumas; Ivan K S Yap; Olivier Cloarec; Gabriela E Bergonzelli; Irene Corthesy-Theulaz; Sunil Kochhar; Elaine Holmes; John C Lindon; Stephen Collins; Jeremy K Nicholson
Transgenomic metabolic interactions in a mouse disease model: interactions of Trichinella spiralis infection with dietary Lactobacillus paracasei supplementation.
Journal of proteome research 2006;5(9):2185-93.
2006: Marc-Emmanuel Dumas; Richard H Barton; Ayo TOYE; Olivier Cloarec; Christine Blancher; Alice Rothwell; Jane F Fearnside; Roger Tatoud; Véronique Blanc; John C Lindon; Stephen C Mitchell; Elaine Holmes; Mark I McCarthy; James Scott; Dominique Gauguier; Jeremy K Nicholson
Metabolic profiling reveals a contribution of gut microbiota to fatty liver phenotype in insulin-resistant mice.
Proceedings of the National Academy of Sciences of the United States of America 2006;103(33):12511-6.
2006: Yulan Wang; Elaine Holmes; Huiru Tang; John C Lindon; norbert sprenger; Marco E Turini; Gabriela E Bergonzelli; Laurent B Fay; Sunil Kochhar; Jeremy K Nicholson
Experimental metabonomic model of dietary variation and stress interactions.
Journal of proteome research 2006;5(7):1535-42.
2006: Derek J Crockford; John C Lindon; Olivier Cloarec; Robert S Plumb; Stephen J Bruce; Séverine Zirah; Paul David Rainville; Chris L Stumpf; Kelly Johnson; Elaine Holmes; Jeremy K Nicholson
Statistical search space reduction and two-dimensional data display approaches for UPLC-MS in biomarker discovery and pathway analysis.
Analytical chemistry 2006;78(13):4398-408.
2006: Stephen J Vanderhoeven; John C Lindon; Jeff Troke; Jeremy K Nicholson; Ian D Wilson
NMR spectroscopic studies of the transacylation reactivity of ibuprofen 1-beta-O-acyl glucuronide.
Journal of pharmaceutical and biomedical analysis 2006;41(3):1002-6.
2006: Arthur L Castle; Oliver Fiehn; Rima Kaddurah-Daouk; John C Lindon
Metabolomics Standards Workshop and the development of international standards for reporting metabolomics experimental results.
Briefings in bioinformatics 2006;7(2):159-65.
2006: John C Lindon; Elaine Holmes; Jeremy K Nicholson
Metabonomics techniques and applications to pharmaceutical research & development.
Pharmaceutical research 2006;23(6):1075-88.
2006: T Andrew Clayton; John C Lindon; Olivier Cloarec; Henrik Antti; Claude Charuel; Gilles Hanton; Jean-Pierre Provost; Jean-Loic Le Net; David Baker; Rosalind J Walley; Jeremy R Everett; Jeremy K Nicholson
Pharmaco-metabonomic phenotyping and personalized drug treatment.
Nature 2006;440(7087):1073-7.
2006: Andrew Craig; Olivier Cloarec; Elaine Holmes; Jeremy K Nicholson; John C Lindon
Scaling and normalization effects in NMR spectroscopic metabonomic data sets.
Analytical chemistry 2006;78(7):2262-7.
2006: Marc-Emmanuel Dumas; Elaine Maibaum; Claire Teague; Hirotsugu Ueshima; Beifan Zhou; John C Lindon; Jeremy K Nicholson; Jeremiah Stamler; Paul Elliott; Queenie Chan; Elaine Holmes
Assessment of analytical reproducibility of 1H NMR spectroscopy based metabonomics for large-scale epidemiological research: the INTERMAP Study.
Analytical chemistry 2006;78(7):2199-208.
2006: Derek J Crockford; Elaine Holmes; John C Lindon; Robert S Plumb; Séverine Zirah; Stephen J Bruce; Paul David Rainville; Chris L Stumpf; Jeremy K Nicholson
Statistical heterospectroscopy, an approach to the integrated analysis of NMR and UPLC-MS data sets: application in metabonomic toxicology studies.
Analytical chemistry 2006;78(2):363-71.
2006: Catherine J Duckett; John C Lindon; Heather Walker; Fadi Abou-Shakra; Ian D Wilson; Jeremy K Nicholson
Metabolism of 3-chloro-4-fluoroaniline in rat using [14C]-radiolabelling, 19F-NMR spectroscopy, HPLC-MS/MS, HPLC-ICPMS and HPLC-NMR.
Xenobiotica; the fate of foreign compounds in biological systems 2006;36(1):59-77.
2005: John C Lindon; Hector C Keun; Timothy M D Ebbels; Jake Mt Pearce; Elaine Holmes; Jeremy K Nicholson
The Consortium for Metabonomic Toxicology (COMET): aims, activities and achievements.
Pharmacogenomics 2005;6(7):691-9.
2005: Iola F Duarte; Elizabeth G Stanley; Elaine Holmes; John C Lindon; Ana M Gil; Huiru Tang; Roxanne Ferdinand; Claire Gavaghan; Jeremy K Nicholson; Hector Vilca-Melendez; Nigel Heaton; Gerard M Murphy
Metabolic assessment of human liver transplants from biopsy samples at the donor and recipient stages using high-resolution magic angle spinning 1H NMR spectroscopy.
Analytical chemistry 2005;77(17):5570-8.
2005: E Skordi; Ian D Wilson; John C Lindon; Jeremy K Nicholson
Kinetic studies on the intramolecular acyl migration of beta-1-O-acyl glucuronides: application to the glucuronides of (R)- and (S)-ketoprofen, (R)- and (S)-hydroxy-ketoprofen metabolites, and tolmetin by 1H-NMR spectroscopy.
Xenobiotica; the fate of foreign compounds in biological systems 2005;35(7):715-25.
2005: Yulan Wang; Huiru Tang; Elaine Holmes; John C Lindon; Marco E Turini; norbert sprenger; Gabriela E Bergonzelli; Laurent B Fay; Sunil Kochhar; Jeremy K Nicholson
Biochemical characterization of rat intestine development using high-resolution magic-angle-spinning 1H NMR spectroscopy and multivariate data analysis.
Journal of proteome research 2005;4(4):1324-9.
2005: Mary E Bollard; Elizabeth G Stanley; John C Lindon; Jeremy K Nicholson; Elaine Holmes
NMR-based metabonomic approaches for evaluating physiological influences on biofluid composition.
NMR in biomedicine 2005;18(3):143-62.
2005: Mary E Bollard; Hector C Keun; Olaf Beckonert; Timothy M D Ebbels; Henrik Antti; Andrew Nicholls; John P Shockcor; Glenn H Cantor; Greg Stevens; John C Lindon; Elaine Holmes; Jeremy K Nicholson
Comparative metabonomics of differential hydrazine toxicity in the rat and mouse.
Toxicology and applied pharmacology 2005;204(2):135-51.
2005: Olivier Cloarec; Marc-Emmanuel Dumas; Andrew Craig; Richard H Barton; Johan Trygg; Jane Hudson; Christine Blancher; Dominique Gauguier; John C Lindon; Elaine Holmes; Jeremy Nicholson
Statistical total correlation spectroscopy: an exploratory approach for latent biomarker identification from metabolic 1H NMR data sets.
Analytical chemistry 2005;77(5):1282-9.
2005: Olivier Cloarec; Marc-Emmanuel Dumas; Johan Trygg; Andrew Craig; Richard H Barton; John C Lindon; Jeremy K Nicholson; Elaine Holmes
Evaluation of the orthogonal projection on latent structure model limitations caused by chemical shift variability and improved visualization of biomarker changes in 1H NMR spectroscopic metabonomic studies.
Analytical chemistry 2005;77(2):517-26.
2004: Timothy M D Ebbels; Elaine Holmes; John C Lindon; Jeremy K Nicholson
Evaluation of metabolic variation in normal rat strains from a statistical analysis of 1H NMR spectra of urine.
Journal of pharmaceutical and biomedical analysis 2004;36(4):823-33.
2004: E Skordi; Ian D Wilson; John C Lindon; Jeremy K Nicholson
Characterization and quantification of metabolites of racemic ketoprofen excreted in urine following oral administration to man by 1H-NMR spectroscopy, directly coupled HPLC-MS and HPLC-NMR, and circular dichroism.
Xenobiotica; the fate of foreign compounds in biological systems 2004;34(11-12):1075-89.
2004: Jacob G Bundy; David J Spurgeon; Claus Svendsen; Peter K Hankard; Jason M Weeks; Daniel Osborn; John C Lindon; Jeremy K Nicholson
Environmental metabonomics: applying combination biomarker analysis in earthworms at a metal contaminated site.
Ecotoxicology (London, England) 2004;13(8):797-806.
2004: Stephen J Vanderhoeven; Jeff Troke; George E Tranter; Ian D Wilson; Jeremy K Nicholson; John C Lindon
Nuclear magnetic resonance (NMR) and quantitative structure-activity relationship (QSAR) studies on the transacylation reactivity of model 1beta-O-acyl glucuronides. II: QSAR modelling of the reaction using both computational and experimental NMR parameters.
Xenobiotica; the fate of foreign compounds in biological systems 2004;34(10):889-900.
2004: Jeremy K Nicholson; Elaine Holmes; John C Lindon; Ian D Wilson
The challenges of modeling mammalian biocomplexity.
Nature biotechnology 2004;22(10):1268-74.
2004: Radka Stoyanova; Andrew Nicholls; Jeremy K Nicholson; John C Lindon; Truman R Brown
Automatic alignment of individual peaks in large high-resolution spectral data sets.
Journal of magnetic resonance (San Diego, Calif. : 1997) 2004;170(2):329-35.
2004: Radka Stoyanova; Jeremy K Nicholson; John C Lindon; Truman R Brown
Sample classification based on Bayesian spectral decomposition of metabonomic NMR data sets.
Analytical chemistry 2004;76(13):3666-74.
2004: John C Lindon; Elaine Holmes; Jeremy K Nicholson
Metabonomics: systems biology in pharmaceutical research and development.
Current opinion in molecular therapeutics 2004;6(3):265-72.
2004: Muireann Coen; Ian D Wilson; Jeremy K Nicholson; Huiru Tang; John C Lindon
Probing molecular dynamics in chromatographic systems using high-resolution 1H magic-angle-spinning NMR spectroscopy: interaction between p-Xylene and C18-bonded silica.
Analytical chemistry 2004;76(11):3023-8.
2004: Hector C Keun; Timothy M D Ebbels; Mary E Bollard; Olaf Beckonert; Henrik Antti; Elaine Holmes; John C Lindon; Jeremy K Nicholson
Geometric trajectory analysis of metabolic responses to toxicity can define treatment specific profiles.
Chemical research in toxicology 2004;17(5):579-87.
2004: Muireann Coen; Stefan U Ruepp; John C Lindon; Jeremy K Nicholson; François Pognan; Eva M Lenz; Ian D Wilson
Integrated application of transcriptomics and metabonomics yields new insight into the toxicity due to paracetamol in the mouse.
Journal of pharmaceutical and biomedical analysis 2004;35(1):93-105.
2004: John C Lindon; Elaine Holmes; Jeremy K Nicholson
Metabonomics and its role in drug development and disease diagnosis.
Expert review of molecular diagnostics 2004;4(2):189-99.
2004: Huiru Tang; Yulan Wang; Jeremy K Nicholson; John C Lindon
Use of relaxation-edited one-dimensional and two dimensional nuclear magnetic resonance spectroscopy to improve detection of small metabolites in blood plasma.
Analytical biochemistry 2004;325(2):260-72.
2004: T Andrew Clayton; John C Lindon; Jeremy R Everett; Claude Charuel; Gilles Hanton; Jean-Loic Le Net; Jean-Pierre Provost; Jeremy K Nicholson
Hepatotoxin-induced hypercreatinaemia and hypercreatinuria: their relationship to one another, to liver damage and to weakened nutritional status.
Archives of toxicology 2004;78(2):86-96.
2004: Stephen J Vanderhoeven; John C Lindon; Jeff Troke; George E Tranter; Ian D Wilson; Jeremy K Nicholson
NMR and QSAR studies on the transacylation reactivity of model 1beta-O-acyl glucuronides. I: design, synthesis and degradation rate measurement.
Xenobiotica; the fate of foreign compounds in biological systems 2004;34(1):73-85.
2004: John C Lindon; Elaine Holmes; Mary E Bollard; Elizabeth G Stanley; Jeremy K Nicholson
Metabonomics technologies and their applications in physiological monitoring, drug safety assessment and disease diagnosis.
Biomarkers : biochemical indicators of exposure, response, and susceptibility to chemicals 2004;9(1):1-31.
2003: Yulan Wang; Mary E Bollard; Hector C Keun; Henrik Antti; Olaf Beckonert; Timothy M D Ebbels; John C Lindon; Elaine Holmes; Huiru Tang; Jeremy K Nicholson
Spectral editing and pattern recognition methods applied to high-resolution magic-angle spinning 1H nuclear magnetic resonance spectroscopy of liver tissues.
Analytical biochemistry 2003;323(1):26-32.
2003: John C Lindon
HPLC-NMR-MS: past, present and future.
Drug discovery today 2003;8(22):1021-2.
2003: John C Lindon; Elaine Holmes; Jeremy K Nicholson
So what's the deal with metabonomics?
Analytical chemistry 2003;75(17):384A-391A.
2003: Kirty S Solanky; Nigel J C Bailey; Elaine Holmes; John C Lindon; Adrienne L Davis; Theo P J Mulder; John P M van Duynhoven; Jeremy K Nicholson
NMR-based metabonomic studies on the biochemical effects of epicatechin in the rat.
Journal of agricultural and food chemistry 2003;51(14):4139-45.
2003: Bridgette M Beckwith-Hall; Nicholas A Thompson; Jeremy K Nicholson; John C Lindon; Elaine Holmes
A metabonomic investigation of hepatotoxicity using diffusion-edited 1H NMR spectroscopy of blood serum.
The Analyst 2003;128(7):814-8.
2003: T Andrew Clayton; John C Lindon; Jeremy R Everett; Claude Charuel; Gilles Hanton; Jean-Loic Le Net; Jean-Pierre Provost; Jeremy K Nicholson
An hypothesis for a mechanism underlying hepatotoxin-induced hypercreatinuria.
Archives of toxicology 2003;77(4):208-17.
2003: John C Lindon; Jeremy K Nicholson; Elaine Holmes; Henrik Antti; Mary E Bollard; Hector C Keun; Olaf Beckonert; Timothy M D Ebbels; Michael D Reily; Donald Robertson; Gregory J Stevens; Peter Luke; Alan P Breau; Glenn H Cantor; Roy H Bible; Urs Niederhauser; Hans Senn; Götz Schlotterbeck; Ulla G Sidelmann; Steen M Laursen; Adrienne A Tymiak; Bruce D Car; Lois D Lehman-McKeeman; Jean Marie Colet; Ali Loukaci; Craig Thomas
Contemporary issues in toxicology the role of metabonomics in toxicology and its evaluation by the COMET project.
Toxicology and applied pharmacology 2003;187(3):137-46.
2003: Muireann Coen; Eva M Lenz; Jeremy K Nicholson; Ian D Wilson; François Pognan; John C Lindon
An integrated metabonomic investigation of acetaminophen toxicity in the mouse using NMR spectroscopy.
Chemical research in toxicology 2003;16(3):295-303.
2003: Eva M Lenz; John C Lindon; Jeremy K Nicholson; Jason M Weeks; Daniel Osborn
19F NMR spectroscopic investigation into the absorption and metabolism of 3-trifluoromethylaniline in Eisenia veneta.
Ecotoxicology and environmental safety 2003;54(2):157-68.
2003: Catherine J Duckett; Ian D Wilson; Heather Walker; Fadi Abou-Shakra; John C Lindon; Jeremy K Nicholson
High-performance liquid chromatography/inductively coupled plasma mass spectrometry with iodine-specific detection for profiling the metabolites produced in the earthworm Eisenia veneta by exposure to 2-fluoro-4-iodoaniline.
Rapid communications in mass spectrometry : RCM 2003;17(16):1855-8.
2003: M Tugnait; Eva M Lenz; M Hofmann; Manfred Spraul; Ian D Wilson; John C Lindon; Jeremy K Nicholson
The metabolism of 2-trifluormethylaniline and its acetanilide in the rat by 19F NMR monitored enzyme hydrolysis and 1H/19F HPLC-NMR spectroscopy.
Journal of pharmaceutical and biomedical analysis 2003;30(5):1561-74.
2002: Hector C Keun; Timothy M D Ebbels; Henrik Antti; Mary E Bollard; Olaf Beckonert; Götz Schlotterbeck; Hans Senn; Urs Niederhauser; Elaine Holmes; John C Lindon; Jeremy K Nicholson
Analytical reproducibility in (1)H NMR-based metabonomic urinalysis.
Chemical research in toxicology 2002;15(11):1380-6.
2002: Hector C Keun; Olaf Beckonert; Julian L Griffin; Christian Richter; Detlef Moskau; John C Lindon; Jeremy K Nicholson
Cryogenic probe 13C NMR spectroscopy of urine for metabonomic studies.
Analytical chemistry 2002;74(17):4588-93.
2002: Bridgette M Beckwith-Hall; Elaine Holmes; John C Lindon; John Gounarides; Alison Vickers; michael shapiro; Jeremy K Nicholson
NMR-based metabonomic studies on the biochemical effects of commonly used drug carrier vehicles in the rat.
Chemical research in toxicology 2002;15(9):1136-41.
2002: Jacob G Bundy; Eva M Lenz; Nigel J C Bailey; Claire Gavaghan; Claus Svendsen; David Spurgeon; Peter K Hankard; Daniel Osborn; Jason M Weeks; Sunia A Trauger; Paul Speir; Ian Sanders; John C Lindon; Jeremy K Nicholson; Huiru Tang
Metabonomic assessment of toxicity of 4-fluoroaniline, 3,5-difluoroaniline and 2-fluoro-4-methylaniline to the earthworm Eisenia veneta (Rosa): identification of new endogenous biomarkers.
Environmental toxicology and chemistry / SETAC 2002;21(9):1966-72.
2002: Jacob G Bundy; David J Spurgeon; Claus Svendsen; Peter K Hankard; Daniel Osborn; John C Lindon; Jeremy K Nicholson
Earthworm species of the genus Eisenia can be phenotypically differentiated by metabolic profiling.
FEBS letters 2002;521(1-3):115-20.
2002: Eva M Lenz; John C Lindon; Jeremy K Nicholson; Jason M Weeks; Daniel Osborn
19F-NMR and directly coupled 19F/1H-HPLC-NMR spectroscopic investigations of the metabolism of the model ecotoxin 3-trifluoromethylaniline in the earthworm species Eisenia veneta.
Xenobiotica; the fate of foreign compounds in biological systems 2002;32(6):535-46.
2002: Jacob G Bundy; Eva M Lenz; Daniel Osborn; Jason M Weeks; John C Lindon; Jeremy K Nicholson
Metabolism of 4-fluoroaniline and 4-fluorobiphenyl in the earthworm Eisenia veneta characterized by high-resolution NMR spectroscopy with directly coupled HPLC-NMR and HPLC-MS.
Xenobiotica; the fate of foreign compounds in biological systems 2002;32(6):479-90.
2002: M Tugnait; Eva M Lenz; P Phillips; M Hofmann; Manfred Spraul; John C Lindon; Jeremy K Nicholson; Ian D Wilson
The metabolism of 4-trifluoromethoxyaniline and [13C]-4-trifluoromethoxyacetanilide in the rat: detection and identification of metabolites excreted in the urine by NMR and HPLC-NMR.
Journal of pharmaceutical and biomedical analysis 2002;28(5):875-85.
2002: Clare A Daykin; Peta J D Foxall; Susan C Connor; John C Lindon; Jeremy K Nicholson
The comparison of plasma deproteinization methods for the detection of low-molecular-weight metabolites by (1)H nuclear magnetic resonance spectroscopy.
Analytical biochemistry 2002;304(2):220-30.
2002: Graeme Scarfe; Jeremy K Nicholson; John C Lindon; Ian D Wilson; S Taylor; E Clayton; B Wright
Identification of the urinary metabolites of 4-bromoaniline and 4-bromo-[carbonyl-13C]-acetanilide in rat.
Xenobiotica; the fate of foreign compounds in biological systems 2002;32(4):325-37.
2002: Graeme Scarfe; Ian D Wilson; MA Warne; Elaine Holmes; Jeremy K Nicholson; John C Lindon
Structure-metabolism relationships of substituted anilines: prediction of N-acetylation and N-oxanilic acid formation using computational chemistry.
Xenobiotica; the fate of foreign compounds in biological systems 2002;32(4):267-77.
2002: Eva M Lenz; Ian D Wilson; B Wright; E A Partridge; C T Rodgers; P R Haycock; John C Lindon; Jeremy K Nicholson
A comparison of quantitative NMR and radiolabelling studies of the metabolism and excretion of Statil (3-(4-bromo-2-fluorobenzyl)-4-oxo-3H-phthalazin-1-ylacetic acid) in the rat.
Journal of pharmaceutical and biomedical analysis 2002;28(1):31-43.
2002: Jeremy K Nicholson; John Connelly; John C Lindon; Elaine Holmes
Metabonomics: a platform for studying drug toxicity and gene function.
Nature reviews. Drug discovery 2002;1(2):153-61.
2002: Catherine J Duckett; Nigel J C Bailey; Heather Walker; Fadi Abou-Shakra; Ian D Wilson; John C Lindon; Jeremy K Nicholson
Quantitation in gradient high performance liquid chromatography/inductively coupled mass spectrometry investigated using diclofenac and chlorpromazine.
Rapid communications in mass spectrometry : RCM 2002;16(4):245-7.
2001: Olivia Corcoran; John C Lindon; R Hall; I M Ismail; Jeremy K Nicholson
The potential of 19F NMR spectroscopy for rapid screening of cell cultures for models of mammalian drug metabolism.
The Analyst 2001;126(12):2103-6.
2001: Mary E Bollard; Elaine Holmes; John C Lindon; Stephen C Mitchell; D Branstetter; W Zhang; Jeremy K Nicholson
Investigations into biochemical changes due to diurnal variation and estrus cycle in female rats using high-resolution (1)H NMR spectroscopy of urine and pattern recognition.
Analytical biochemistry 2001;295(2):194-202.
2001: Andrew Nicholls; Elaine Holmes; John C Lindon; John P Shockcor; R Duncan Farrant; John N Haselden; SJ Damment; Catherine J Waterfield; Jeremy K Nicholson
Metabonomic investigations into hydrazine toxicity in the rat.
Chemical research in toxicology 2001;14(8):975-87.
2001: Jacob G Bundy; Daniel Osborn; Jason M Weeks; John C Lindon; Jeremy K Nicholson
An NMR-based metabonomic approach to the investigation of coelomic fluid biochemistry in earthworms under toxic stress.
FEBS letters 2001;500(1-2):31-5.
2001: Muireann Coen; John C Lindon; Claire Gavaghan; Elaine Holmes; Eberhard Humpfer; Ian D Wilson; PD Stanley; Jeremy K Nicholson
Investigation of water environments in a C18 bonded silica phase using 1H magic angle spinning (MAS) nuclear magnetic resonance (NMR) spectroscopy.
The Analyst 2001;126(5):548-50.
2001: Jeremy K Nicholson; John C Lindon; Graeme Scarfe; Ian D Wilson; Fadi Abou-Shakra; A B Sage; Jose Castro-Perez
High-performance liquid chromatography linked to inductively coupled plasma mass spectrometry and orthogonal acceleration time-of-flight mass spectrometry for the simultaneous detection and identification of metabolites of 2-bromo-4-trifluoromethyl.
Analytical chemistry 2001;73(7):1491-4.
2001: anne Rosemary Tate; SJ Damment; John C Lindon
Investigation of the metabolite variation in control rat urine using (1)H NMR spectroscopy.
Analytical biochemistry 2001;291(1):17-26.
2001: Rasmus Worm Mortensen; O Corcoran; Claus Cornett; Ulla G Sidelmann; John C Lindon; Jeremy K Nicholson; Steen H Hansen
S-naproxen-beta-1-O-acyl glucuronide degradation kinetic studies by stopped-flow high-performance liquid chromatography-1H NMR and high-performance liquid chromatography-UV.
Drug metabolism and disposition: the biological fate of chemicals 2001;29(4 Pt 1):375-80.
2001: C A Daykin; O Corcoran; Steen H Hansen; Inga Bjørnsdottir; Claus Cornett; Susan C Connor; John C Lindon; Jeremy K Nicholson
Application of directly coupled HPLC NMR to separation and characterization of lipoproteins from human serum.
Analytical chemistry 2001;73(6):1084-90.
2001: Ulla G Sidelmann; Inga Bjørnsdottir; J P Shockcor; Steen H Hansen; John C Lindon; Jeremy K Nicholson
Directly coupled HPLC-NMR and HPLC-MS approaches for the rapid characterisation of drug metabolites in urine: application to the human metabolism of naproxen.
Journal of pharmaceutical and biomedical analysis 2001;24(4):569-79.
2001: Rasmus Worm Mortensen; O Corcoran; Claus Cornett; Ulla G Sidelmann; Jeff Troke; John C Lindon; Jeremy K Nicholson; Steen H Hansen
LC-1H NMR used for determination of the elution order of S-naproxen glucuronide isomers in two isocratic reversed-phase LC-systems.
Journal of pharmaceutical and biomedical analysis 2001;24(3):477-85.
2000: Julian L Griffin; Jeff Troke; LA Walker; Richard F Shore; John C Lindon; Jeremy K Nicholson
The biochemical profile of rat testicular tissue as measured by magic angle spinning 1H NMR spectroscopy.
FEBS letters 2000;486(3):225-9.
2000: John P Shockcor; Steve E Unger; P Savina; Jeremy K Nicholson; John C Lindon
Application of directly coupled LC-NMR-MS to the structural elucidation of metabolites of the HIV-1 reverse-transcriptase inhibitor BW935U83.
Journal of chromatography. B, Biomedical sciences and applications 2000;748(1):269-79.
2000: John C Lindon; Jeremy K Nicholson; Ian D Wilson
Directly coupled HPLC-NMR and HPLC-NMR-MS in pharmaceutical research and development.
Journal of chromatography. B, Biomedical sciences and applications 2000;748(1):233-58.
2000: Mary E Bollard; Sarah Garrod; Elaine Holmes; John C Lindon; Eberhard Humpfer; Manfred Spraul; Jeremy K Nicholson
High-resolution (1)H and (1)H-(13)C magic angle spinning NMR spectroscopy of rat liver.
Magnetic resonance in medicine : official journal of the Society of Magnetic Resonance in Medicine / Society of Magnetic Resonance in Medicine 2000;44(2):201-7.
2000: Graeme Scarfe; John C Lindon; Jeremy K Nicholson; P Martin; B Wright; S Taylor; Eva M Lenz; Ian D Wilson
Investigation of the metabolism of 14C/13C-practolol in rat using directly coupled radio-HPLC-NMR-MS.
Xenobiotica; the fate of foreign compounds in biological systems 2000;30(7):717-29.
2000: Nigel J Waters; Sarah Garrod; R Duncan Farrant; John N Haselden; Susan C Connor; John Connelly; John C Lindon; Elaine Holmes; Jeremy K Nicholson
High-resolution magic angle spinning (1)H NMR spectroscopy of intact liver and kidney: optimization of sample preparation procedures and biochemical stability of tissue during spectral acquisition.
Analytical biochemistry 2000;282(1):16-23.
2000: Elaine Holmes; Andrew Nicholls; John C Lindon; Susan C Connor; John C Connelly; John N Haselden; SJ Damment; Manfred Spraul; P Neidig; Jeremy K Nicholson
Chemometric models for toxicity classification based on NMR spectra of biofluids.
Chemical research in toxicology 2000;13(6):471-8.
2000: anne Rosemary Tate; Peta J D Foxall; Elaine Holmes; Detlef Moka; Manfred Spraul; Jeremy K Nicholson; John C Lindon
Distinction between normal and renal cell carcinoma kidney cortical biopsy samples using pattern recognition of (1)H magic angle spinning (MAS) NMR spectra.
NMR in biomedicine 2000;13(2):64-71.
2000: Jeremy K Nicholson; John C Lindon; Graeme Scarfe; Ian D Wilson; Fadi Abou-Shakra; Jose Castro-Perez; A Eaton; S Preece
High-performance liquid chromatography and inductively coupled plasma mass spectrometry (HPLC-ICP-MS) for the analysis of xenobiotic metabolites in rat urine: application to the metabolites of 4-bromoaniline.
The Analyst 2000;125(2):235-6.
2000: Nigel J C Bailey; PD Stanley; ST Hadfield; John C Lindon; Jeremy K Nicholson
Mass spectrometrically detected directly coupled high performance liquid chromatography/nuclear magnetic resonance spectroscopy/mass spectrometry for the identification of xenobiotic metabolites in maize plants.
Rapid communications in mass spectrometry : RCM 2000;14(8):679-84.
2000: Nigel J C Bailey; P Cooper; ST Hadfield; Eva M Lenz; John C Lindon; Jeremy K Nicholson; PD Stanley; Ian D Wilson; B Wright; S D Taylor
Application of directly coupled HPLC-NMR-MS/MS to the identification of metabolites of 5-trifluoromethylpyridone (2-hydroxy-5-trifluoromethylpyridine) in hydroponically grown plants.
Journal of agricultural and food chemistry 2000;48(1):42-6.
1999: Jeremy K Nicholson; John C Lindon; Elaine Holmes
'Metabonomics': understanding the metabolic responses of living systems to pathophysiological stimuli via multivariate statistical analysis of biological NMR spectroscopic data.
Xenobiotica; the fate of foreign compounds in biological systems 1999;29(11):1181-9.
1999: Graeme Scarfe; John C Lindon; Jeremy K Nicholson; B Wright; E Clayton; Ian D Wilson
Investigation of the quantitative metabolic fate and urinary excretion of 3-methyl-4-trifluoromethylaniline and 3-methyl-4-trifluoromethylacetanilide in the rat.
Drug metabolism and disposition: the biological fate of chemicals 1999;27(10):1171-8.
1999: Andrew Nicholls; John C Lindon; R Duncan Farrant; John P Shockcor; Ian D Wilson; Jeremy K Nicholson
Directly-coupled HPLC-NMR spectroscopic studies of metabolism and futile deacetylation of phenacetin in the rat.
Journal of pharmaceutical and biomedical analysis 1999;20(6):865-73.
1999: MA Warne; Daniel Osborn; John C Lindon; Jeremy K Nicholson
Quantitative structure-toxicity relationships for halogenated substituted-benzenes to Vibrio fischeri, using atom-based semi-empirical molecular-orbital descriptors.
Chemosphere 1999;38(14):3357-82.
1999: Sarah Garrod; Eberhard Humpfer; Manfred Spraul; Susan C Connor; S Polley; John Connelly; John C Lindon; Jeremy K Nicholson; Elaine Holmes
High-resolution magic angle spinning 1H NMR spectroscopic studies on intact rat renal cortex and medulla.
Magnetic resonance in medicine : official journal of the Society of Magnetic Resonance in Medicine / Society of Magnetic Resonance in Medicine 1999;41(6):1108-18.
1999: C B Abel; John C Lindon; D Noble; Brian A M Rudd; Philip J Sidebottom; Jeremy K Nicholson
Characterization of metabolites in intact Streptomyces citricolor culture supernatants using high-resolution nuclear magnetic resonance and directly coupled high-pressure liquid chromatography-nuclear magnetic resonance spectroscopy.
Analytical biochemistry 1999;270(2):220-30.
1999: N Mistry; I M Ismail; R Duncan Farrant; M Liu; J K Nicholson; John C Lindon
Impurity profiling in bulk pharmaceutical batches using 19F NMR spectroscopy and distinction between monomeric and dimeric impurities by NMR-based diffusion measurements.
Journal of pharmaceutical and biomedical analysis 1999;19(3-4):511-7.
1999: MA Warne; E M Boyd; Andrew A Meharg; Daniel Osborn; Ken Killham; John C Lindon; Jeremy K Nicholson
Quantitative structure-toxicity relationships for chlorophenols to bioluminescent lux-marked bacteria using atom-based semi-empirical molecular-orbital descriptors.
SAR and QSAR in environmental research 1999;10(5):473-95.
1999: Graeme Scarfe; B Wright; E Clayton; S Taylor; Ian D Wilson; John C Lindon; Jeremy K Nicholson
Quantitative studies on the urinary metabolic fate of 2-chloro-4-trifluoromethylaniline in the rat using 19F-NMR spectroscopy and directly coupled HPLC-NMR-MS.
Xenobiotica; the fate of foreign compounds in biological systems 1999;29(1):77-91.
1999: B C Cupid; Elaine Holmes; Ian D Wilson; John C Lindon; Jeremy K Nicholson
Quantitative structure-metabolism relationships (QSMR) using computational chemistry: pattern recognition analysis and statistical prediction of phase II conjugation reactions of substituted benzoic acids in the rat.
Xenobiotica; the fate of foreign compounds in biological systems 1999;29(1):27-42.
1998: J Schewitz; Petra Gfrörer; K Pusecker; LH Tseng; Klaus Albert; Ernst Bayer; Ian D Wilson; N J Bailey; Graeme Scarfe; Jeremy K Nicholson; John C Lindon
Directly coupled CZE-NMR and CEC-NMR spectroscopy for metabolite analysis: paracetamol metabolites in human urine.
The Analyst 1998;123(12):2835-7.
1998: Elaine Holmes; Andrew Nicholls; John C Lindon; S Ramos; Manfred Spraul; P Neidig; Susan C Connor; John Connelly; SJ Damment; John N Haselden; Jeremy K Nicholson
Development of a model for classification of toxin-induced lesions using 1H NMR spectroscopy of urine combined with pattern recognition.
NMR in biomedicine 1998;11(4-5):235-44.
1998: Detlef Moka; R Vorreuther; H Schicha; Manfred Spraul; Eberhard Humpfer; M Lipinski; Peta J D Foxall; Jeremy K Nicholson; John C Lindon
Biochemical classification of kidney carcinoma biopsy samples using magic-angle-spinning 1H nuclear magnetic resonance spectroscopy.
Journal of pharmaceutical and biomedical analysis 1998;17(1):125-32.
1998: Graeme Scarfe; B Wright; E Clayton; S Taylor; Ian D Wilson; John C Lindon; Jeremy K Nicholson
19F-NMR and directly coupled HPLC-NMR-MS investigations into the metabolism of 2-bromo-4-trifluoromethylaniline in rat: a urinary excretion balance study without the use of radiolabelling.
Xenobiotica; the fate of foreign compounds in biological systems 1998;28(4):373-88.
1998: B M Beckwith-Hall; Jeremy K Nicholson; Andrew Nicholls; Peta J D Foxall; John C Lindon; Susan C Connor; M Abdi; John Connelly; Elaine Holmes
Nuclear magnetic resonance spectroscopic and principal components analysis investigations into biochemical effects of three model hepatotoxins.
Chemical research in toxicology 1998;11(4):260-72.
1997: Olivia Corcoran; Manfred Spraul; M Hofmann; I M Ismail; John C Lindon; Jeremy K Nicholson
750 MHz HPLC-NMR spectroscopic identification of rat microsomal metabolites of phenoxypyridines.
Journal of pharmaceutical and biomedical analysis 1997;16(3):481-9.
1997: Andrew Nicholls; John C Lindon; S Caddick; R Duncan Farrant; Ian D Wilson; Jeremy K Nicholson
NMR spectroscopic studies on the metabolism and futile deacetylation of phenacetin in the rat.
Xenobiotica; the fate of foreign compounds in biological systems 1997;27(11):1175-86.
1997: R Duncan Farrant; B C Cupid; Jeremy K Nicholson; John C Lindon
Investigation of the feasibility of directly-coupled HPLC-NMR with 2H detection with application to the metabolism of N-dimethylformamide-d7.
Journal of pharmaceutical and biomedical analysis 1997;16(1):1-5.
1997: John C Lindon; Jeremy K Nicholson; Ulla G Sidelmann; Ian D Wilson
Directly coupled HPLC-NMR and its application to drug metabolism.
Drug metabolism reviews 1997;29(3):705-46.
1997: Eberhard Humpfer; Manfred Spraul; Andrew Nicholls; Jeremy K Nicholson; John C Lindon
Direct observation of resolved intracellular and extracellular water signals in intact human red blood cells using 1H MAS NMR spectroscopy.
Magnetic resonance in medicine : official journal of the Society of Magnetic Resonance in Medicine / Society of Magnetic Resonance in Medicine 1997;38(2):334-6.
1997: Elaine Holmes; Peta J D Foxall; Manfred Spraul; R Duncan Farrant; Jeremy K Nicholson; John C Lindon
750 MHz 1H NMR spectroscopy characterisation of the complex metabolic pattern of urine from patients with inborn errors of metabolism: 2-hydroxyglutaric aciduria and maple syrup urine disease.
Journal of pharmaceutical and biomedical analysis 1997;15(11):1647-59.
1997: M Liu; Jeremy K Nicholson; J A Parkinson; John C Lindon
Measurement of biomolecular diffusion coefficients in blood plasma using two-dimensional 1H-1H diffusion-edited total-correlation NMR spectroscopy.
Analytical chemistry 1997;69(8):1504-9.
1997: Andrew Nicholls; R Duncan Farrant; John P Shockcor; Steve E Unger; Ian D Wilson; John C Lindon; Jeremy K Nicholson
NMR and HPLC-NMR spectroscopic studies of futile deacetylation in paracetamol metabolites in rat and man.
Journal of pharmaceutical and biomedical analysis 1997;15(7):901-10.
1996: John P Shockcor; S E Unger; Ian D Wilson; P J Foxall; Jeremy K Nicholson; John C Lindon
Combined HPLC, NMR spectroscopy, and ion-trap mass spectrometry with application to the detection and characterization of xenobiotic and endogenous metabolites in human urine.
Analytical chemistry 1996;68(24):4431-5.
1996: Andrew Nicholls; K Akira; John C Lindon; R Duncan Farrant; Ian D Wilson; J Harding; D A Killick; Jeremy K Nicholson
NMR spectroscopic and theoretical chemistry studies on the internal acyl migration reactions of the 1-O-acyl-beta-D-glucopyranuronate conjugates of 2-, 3-, and 4-(trifluoromethyl) benzoic acids.
Chemical research in toxicology 1996;9(8):1414-24.
1996: Ulla G Sidelmann; Steen H Hansen; Claire Gavaghan; Andrew Nicholls; H A Carless; John C Lindon; Ian D Wilson; Jeremy K Nicholson
Development of a simple liquid chromatographic method for the separation of mixtures of positional isomers and anomers of synthetic 2-, 3- and 4-fluorobenzoic acid glucuronides formed via acyl migration reactions.
Journal of chromatography. B, Biomedical applications 1996;685(1):113-22.
1996: M Liu; Jeremy K Nicholson; John C Lindon
High-resolution diffusion and relaxation edited one- and two-dimensional 1H NMR spectroscopy of biological fluids.
Analytical chemistry 1996;68(19):3370-6.
1996: E M Lenz; D Greatbanks; Ian D Wilson; Manfred Spraul; M Hofmann; Jeff Troke; John C Lindon; Jeremy K Nicholson
Direct characterization of drug glucuronide isomers in human urine by HPLC-NMR spectroscopy: application to the positional isomers of 6,11-dihydro-11-oxodibenz[b,e]oxepin-2-acetic acid glucuronide.
Analytical chemistry 1996;68(17):2832-7.
1996: Ulla G Sidelmann; Steen H Hansen; Claire Gavaghan; H A Carless; John C Lindon; R D Farrant; Ian D Wilson; Jeremy K Nicholson
Measurement of Internal Acyl Migration Reaction Kinetics Using Directly Coupled HPLC-NMR: Application for the Positional Isomers of Synthetic (2-Fluorobenzoyl)-d-glucopyranuronic Acid.
Analytical chemistry 1996;68(15):2564-72.
1996: P J Foxall; E M Lenz; John C Lindon; Guy H Neild; Ian D Wilson; Jeremy K Nicholson
Nuclear magnetic resonance and high-performance liquid chromatography-nuclear magnetic resonance studies on the toxicity and metabolism of ifosfamide.
Therapeutic drug monitoring 1996;18(4):498-505.
1996: M E Bollard; Elaine Holmes; C A Blackledge; John C Lindon; Ian D Wilson; Jeremy K Nicholson
1H and 19F-nmr spectroscopic studies on the metabolism and urinary excretion of mono- and disubstituted phenols in the rat.
Xenobiotica; the fate of foreign compounds in biological systems 1996;26(3):255-73.
1996: John P Shockcor; R M Wurm; L W Frick; P N Sanderson; R Duncan Farrant; B C Sweatman; John C Lindon
Hplc-nmr identification of the human urinary metabolites of (-)-cis-5-fluoro-1-[2-(hydroxymethyl)-1,3-oxathiolan-5-yl] cytosine, a nucleoside analogue active against human immunodeficiency virus (HIV).
Xenobiotica; the fate of foreign compounds in biological systems 1996;26(2):189-99.
1996: B C Cupid; C R Beddell; John C Lindon; Ian D Wilson; Jeremy K Nicholson
Quantitative structure-metabolism relationships for substituted benzoic acids in the rabbit: prediction of urinary excretion of glycine and glucuronide conjugates.
Xenobiotica; the fate of foreign compounds in biological systems 1996;26(2):157-76.
1996: John P Shockcor; I S Silver; R M Wurm; P N Sanderson; R Duncan Farrant; B C Sweatman; John C Lindon
Characterization of in vitro metabolites from human liver microsomes using directly coupled hplc-nmr: application to a phenoxathiin monoamine oxidase-A inhibitor.
Xenobiotica; the fate of foreign compounds in biological systems 1996;26(1):41-8.
1996: Ulla G Sidelmann; E M Lenz; Manfred Spraul; M Hofmann; Jeff Troke; P N Sanderson; John C Lindon; Ian D Wilson; Jeremy K Nicholson
750 MHz HPLC-NMR spectroscopic studies on the separation and characterization of the positional isomers of the glucuronides of 6,11-dihydro-11-oxodibenz[b,e]oxepin-2-acetic acid.
Analytical chemistry 1996;68(1):106-10.
1995: Elaine Holmes; B C Sweatman; M E Bollard; C A Blackledge; C R Beddell; Ian D Wilson; John C Lindon; Jeremy K Nicholson
Prediction of urinary sulphate and glucuronide conjugate excretion for substituted phenols in the rat using quantitative structure-metabolism relationships.
Xenobiotica; the fate of foreign compounds in biological systems 1995;25(12):1269-81.
1995: R Duncan Farrant; Manfred Spraul; Ian D Wilson; Andrew Nicholls; Jeremy K Nicholson; John C Lindon
Assignment of the 750 MHz 1H NMR resonances from a mixture of transacylated ester glucuronic acid conjugates with the aid of oversampling and digital filtering during acquisition.
Journal of pharmaceutical and biomedical analysis 1995;13(8):971-7.
1995: Elaine Holmes; S Caddick; John C Lindon; Ian D Wilson; S Kryvawych; Jeremy K Nicholson
1H and 2H NMR spectroscopic studies on the metabolism and biochemical effects of 2-bromoethanamine in the rat.
Biochemical pharmacology 1995;49(10):1349-59.
1995: Andrew Nicholls; S Caddick; Ian D Wilson; R Duncan Farrant; John C Lindon; Jeremy K Nicholson
High resolution NMR spectroscopic studies on the metabolism and futile deacetylation of 4-hydroxyacetanilide (paracetamol) in the rat.
Biochemical pharmacology 1995;49(8):1155-64.
1995: Jeremy K Nicholson; P J Foxall; Manfred Spraul; R Duncan Farrant; John C Lindon
750 MHz 1H and 1H-13C NMR spectroscopy of human blood plasma.
Analytical chemistry 1995;67(5):793-811.
1995: M L Anthony; V S Rose; Jeremy K Nicholson; John C Lindon
Classification of toxin-induced changes in 1H NMR spectra of urine using an artificial neural network.
Journal of pharmaceutical and biomedical analysis 1995;13(3):205-11.
1994: Manfred Spraul; M Hofmann; John C Lindon; R Duncan Farrant; M J Seddon; Jeremy K Nicholson; I D Wilson
Evaluation of liquid chromatography coupled with high-field 1H NMR spectroscopy for drug metabolite detection and characterization: the identification of paracetamol metabolites in urine and bile.
NMR in biomedicine 1994;7(7):295-303.
1994: K Akira; R Duncan Farrant; John C Lindon; S T Caddick; Andrew Nicholls; Jeremy K Nicholson
High-field deuterium nuclear magnetic resonance spectroscopic monitoring of the pharmacokinetics of selectively deuterated benzoic acid in man.
Analytical biochemistry 1994;221(2):297-302.
1994: Elaine Holmes; P J Foxall; Jeremy K Nicholson; Guy H Neild; S M Brown; C R Beddell; B C Sweatman; E Rahr; John C Lindon; Manfred Spraul
Automatic data reduction and pattern recognition methods for analysis of 1H nuclear magnetic resonance spectra of human urine from normal and pathological states.
Analytical biochemistry 1994;220(2):284-96.
1994: R Duncan Farrant; John C Lindon; Jeremy K Nicholson
Internal temperature calibration for 1H NMR spectroscopy studies of blood plasma and other biofluids.
NMR in biomedicine 1994;7(5):243-7.
1994: M L Anthony; B C Sweatman; C R Beddell; John C Lindon; Jeremy K Nicholson
Pattern recognition classification of the site of nephrotoxicity based on metabolic data derived from proton nuclear magnetic resonance spectra of urine.
Molecular pharmacology 1994;46(1):199-211.
1994: Manfred Spraul; Jeremy K Nicholson; M J Lynch; John C Lindon
Application of the one-dimensional TOCSY pulse sequence in 750 MHz 1H-NMR spectroscopy for assignment of endogenous metabolite resonances in biofluids.
Journal of pharmaceutical and biomedical analysis 1994;12(5):613-8.
1994: M J Seddon; Manfred Spraul; Ian D Wilson; Jeremy K Nicholson; John C Lindon
Improvement in the characterization of minor drug metabolites from HPLC-NMR studies through the use of quantified maximum entropy processing of NMR spectra.
Journal of pharmaceutical and biomedical analysis 1994;12(3):419-24.
1994: M L Anthony; K P Gartland; C R Beddell; John C Lindon; Jeremy K Nicholson
Studies of the biochemical toxicology of uranyl nitrate in the rat.
Archives of toxicology 1994;68(1):43-53.
1994: M J Lynch; J Masters; J P Pryor; John C Lindon; Manfred Spraul; P J Foxall; Jeremy K Nicholson
Ultra high field NMR spectroscopic studies on human seminal fluid, seminal vesicle and prostatic secretions.
Journal of pharmaceutical and biomedical analysis 1994;12(1):5-19.
1994: M L Anthony; C R Beddell; John C Lindon; Jeremy K Nicholson
Studies on the comparative toxicity of S-(1,2-dichlorovinyl)-L-cysteine, S-(1,2-dichlorovinyl)-L-homocysteine and 1,1,2-trichloro-3,3,3-trifluoro-1-propene in the Fischer 344 rat.
Archives of toxicology 1994;69(2):99-110.
1993: M L Anthony; C R Beddell; John C Lindon; Jeremy K Nicholson
Raised transaminase activity of blood plasma from rats with experimentally-induced kidney damage detected by spin-echo 1H-NMR spectroscopy.
Journal of pharmaceutical and biomedical analysis 1993;11(10):897-902.
1993: R Duncan Farrant; S R Salman; John C Lindon; B C Cupid; Jeremy K Nicholson
Deuterium NMR spectroscopy of biofluids for the identification of drug metabolites: application to N,N-dimethylformamide.
Journal of pharmaceutical and biomedical analysis 1993;11(8):687-92.
1993: B C Sweatman; R Duncan Farrant; Elaine Holmes; F Y Ghauri; Jeremy K Nicholson; John C Lindon
600 MHz 1H-NMR spectroscopy of human cerebrospinal fluid: effects of sample manipulation and assignment of resonances.
Journal of pharmaceutical and biomedical analysis 1993;11(8):651-64.
1993: F Y Ghauri; Jeremy K Nicholson; B C Sweatman; J Wood; C R Beddell; John C Lindon; Nigel J Cairns
NMR spectroscopy of human post mortem cerebrospinal fluid: distinction of Alzheimer's disease from control using pattern recognition and statistics.
NMR in biomedicine 1993;6(2):163-7.
1993: B C Sweatman; R Duncan Farrant; John C Lindon
NMR of biofluids: detection of 2H-acetate and 2H-formate in urine as an indicator of microbiological contamination.
Journal of pharmaceutical and biomedical analysis 1993;11(2):169-72.
1993: P J Foxall; John A Parkinson; Ian H Sadler; John C Lindon; Jeremy K Nicholson
Analysis of biological fluids using 600 MHz proton NMR spectroscopy: application of homonuclear two-dimensional J-resolved spectroscopy to urine and blood plasma for spectral simplification and assignment.
Journal of pharmaceutical and biomedical analysis 1993;11(1):21-31.
1993: P J Foxall; G J Mellotte; M R Bending; John C Lindon; J K Nicholson
NMR spectroscopy as a novel approach to the monitoring of renal transplant function.
Kidney international 1993;43(1):234-45.
1993: M L Anthony; C R Beddell; John C Lindon; Jeremy K Nicholson
Studies on the effects of L(alpha S,5S)-alpha-amino-3-chloro-4,5-dihydro-5-isoxazoleacetic acid (AT-125) on 4-aminophenol-induced nephrotoxicity in the Fischer 344 rat.
Archives of toxicology 1993;67(10):696-705.
1992: F Y Ghauri; C A Blackledge; R C Glen; B C Sweatman; John C Lindon; C R Beddell; Ian D Wilson; Jeremy K Nicholson
Quantitative structure-metabolism relationships for substituted benzoic acids in the rat. Computational chemistry, NMR spectroscopy and pattern recognition studies.
Biochemical pharmacology 1992;44(10):1935-46.
1992: Elaine Holmes; Jeremy K Nicholson; F W Bonner; B C Sweatman; C R Beddell; John C Lindon; E Rahr
Mapping the biochemical trajectory of nephrotoxicity by pattern recognition of NMR urinanalysis.
NMR in biomedicine 1992;5(6):368-72.
1992: Elaine Holmes; F W Bonner; B C Sweatman; John C Lindon; C R Beddell; E Rahr; Jeremy K Nicholson
Nuclear magnetic resonance spectroscopy and pattern recognition analysis of the biochemical processes associated with the progression of and recovery from nephrotoxic lesions in the rat induced by mercury(II) chloride and 2-bromoethanamine.
Molecular pharmacology 1992;42(5):922-30.
1992: A E Aulabaugh; R C Crouch; G E Martin; A Ragouzeos; John P Shockcor; T D Spitzer; R Duncan Farrant; B D Hudson; John C Lindon
The conformational behaviour of the cardiac glycoside digoxin as indicated by NMR spectroscopy and molecular dynamics calculations.
Carbohydrate research 1992;230(2):201-12.
1992: R Duncan Farrant; John C Lindon; E Rahr; B C Sweatman
An automatic data reduction and transfer method to aid pattern recognition analysis and classification of NMR spectra.
Journal of pharmaceutical and biomedical analysis 1992;10(2-3):141-4.
1992: M L Anthony; K P Gartland; C R Beddell; John C Lindon; Jeremy K Nicholson
Cephaloridine-induced nephrotoxicity in the Fischer 344 rat: proton NMR spectroscopic studies of urine and plasma in relation to conventional clinical chemical and histopathological assessments of nephronal damage.
Archives of toxicology 1992;66(8):525-37.
1991: K P Gartland; C R Beddell; John C Lindon; Jeremy K Nicholson
Application of pattern recognition methods to the analysis and classification of toxicological data derived from proton nuclear magnetic resonance spectroscopy of urine.
Molecular pharmacology 1991;39(5):629-42.
1991: T Adrian Carpenter; R J Hodgson; N J Herrod; Laurance D Hall; John C Lindon; A C Honey; John F Martin
Magnetic resonance imaging in a model of atherosclerosis: use of a collar around the rabbit carotid artery.
Magnetic resonance imaging 1991;9(3):365-71.
1990: K P Gartland; S M Sanins; Jeremy K Nicholson; B C Sweatman; C R Beddell; John C Lindon
Pattern recognition analysis of high resolution 1H NMR spectra of urine. A nonlinear mapping approach to the classification of toxicological data.
NMR in biomedicine 1990;3(4):166-72.
1990: R F Booth; A C Honey; John F Martin; John C Lindon; R Duncan Farrant; T Adrian Carpenter; Laurance D Hall
Lipid characterization in an animal model of atherosclerosis using NMR spectroscopy and imaging.
NMR in biomedicine 1990;3(2):95-100.
1990: K P Gartland; M L Anthony; C R Beddell; John C Lindon; Jeremy K Nicholson
Proton NMR studies on the effects of uranyl nitrate on the biochemical composition of rat urine and plasma.
Journal of pharmaceutical and biomedical analysis 1990;8(8-12):951-4.
1990: K P Gartland; C R Beddell; John C Lindon; Jeremy K Nicholson
A pattern recognition approach to the comparison of PMR and clinical chemical data for classification of nephrotoxicity.
Journal of pharmaceutical and biomedical analysis 1990;8(8-12):963-8.