New Advances in Separation Science for Metabolomics: Resolving Chemical Diversity in a Post-Genomic Era

Stability of silica-based, endcapped columns with pH 7 and 11 mobile phases for reversed-phase high-performance liquid chromatography

Kirkland, J. J., Henderson, J. W., DeStefano, J. J., van Straten, M. A., & Claessens, H. A. (1997) · Journal of Chromatography A · doi:10.1016/s0021-9673(96)00945-4 · Cited by 168

Metabolic profiling of human blood by high-resolution ion mobility mass spectrometry (IM-MS)

Dwivedi, P., Schultz, A. J., & Jr, H. H. H. (2010) · International Journal of Mass Spectrometry · doi:10.1016/j.ijms.2010.02.007 · Cited by 168

High Capacity Capillary Electrophoresis-Electrospray Ionization Mass Spectrometry: Coupling a Porous Sheathless Interface with Transient-Isotachophoresis

Busnel, J.-M., Schoenmaker, B., Ramautar, R., Carrasco-Pancorbo, A., Ratnayake, C., Feitelson, J. S., Chapman, J. D., Deelder, A. M., & Mayboroda, O. A. (2010) · Analytical Chemistry · doi:10.1021/ac102159d · Cited by 165

Derivatization reagents in liquid chromatography/electrospray ionization tandem mass spectrometry

Santa, T. (2011) · Biomedical Chromatography · doi:10.1002/bmc.1548 · Cited by 163

Multilevel data analysis of a crossover designed human nutritional intervention study

van Velzen, E. J. J., Westerhuis, J. A., van Duynhoven, J. P. M., van Dorsten, F. A., Hoefsloot, H. C. J., Jacobs, D. M., Smit, S., Draijer, R., Kroner, C. I., & Smilde, A. K. (2008) · Journal of Proteome Research · doi:10.1021/pr800145j · Cited by 161

Mass spectrometry based environmental metabolomics: a primer and review

Viant, M. R., & Sommer, U. (2013) · Metabolomics · doi:10.1007/s11306-012-0412-x · Cited by 158

Model‐driven multi‐omic data analysis elucidates metabolic immunomodulators of macrophage activation

Bordbar, A., Mo, M. L., Nakayasu, E. S., Schrimpe‐Rutledge, A. C., Kim, Y., Metz, T., Jones, M. B., Frank, B. C., Smith, R. D., Peterson, S. N., et al. (2012) · Molecular Systems Biology · doi:10.1038/msb.2012.21 · Cited by 157

Direct infusion mass spectrometry or liquid chromatography mass spectrometry for human metabonomics? A serum metabonomic study of kidney cancer

Lin, L., Yu, Q., Yan, X., Hang, W., Zheng, J., Xing, J., & Huang, B. (2010) · The Analyst · doi:10.1039/c0an00265h · Cited by 155

Recent developments and applications of stir bar sorptive extraction

Lanças, F. M., Queiroz, M. E. C., Grossi, P., & Olivares, I. R. B. (2009) · Journal of Separation Science · doi:10.1002/jssc.200800669 · Cited by 154

Effects of sample handling and storage on quantitative lipid analysis in human serum

Zivkovic, A. M., Wiest, M. M., Nguyen, U. T., Davis, R., Watkins, S. M., & German, J. B. (2009) · Metabolomics · doi:10.1007/s11306-009-0174-2 · Cited by 154

Towards high-throughput metabolomics using ultrahigh-field Fourier transform ion cyclotron resonance mass spectrometry

Han, J., Danell, R. M., Patel, J. R., Gumerov, D. R., Scarlett, C. O., Speir, J. P., Parker, C. E., Rusyn, I., Zeisel, S. H., & Borchers, C. H. (2008) · Metabolomics · doi:10.1007/s11306-008-0104-8 · Cited by 152

CE‐MS for metabolomics: Developments and applications in the period 2008–2010

Ramautar, R., Mayboroda, O. A., Somsen, G. W., & de Jong, G. J. (2010) · Electrophoresis · doi:10.1002/elps.201000378 · Cited by 152

Plasma esterified and non-esterified fatty acids metabolic profiling using gas chromatography–mass spectrometry and its application in the study of diabetic mellitus and diabetic nephropathy

Han, L., Xia, J., Liang, Q., Wang, Y., Wang, Y., Hu, P., Li, P., & Luo, G. (2011) · Analytica Chimica Acta · doi:10.1016/j.aca.2011.01.034 · Cited by 151

Ultra‐performance liquid chromatography coupled to mass spectrometry as a sensitive and powerful technology for metabolomic studies

Wang, X., Sun, H. J., Zhang, A., Wang, P., & Han, Y. (2011) · Journal of Separation Science · doi:10.1002/jssc.201100333 · Cited by 151

Multi-platform characterization of the human cerebrospinal fluid metabolome: a comprehensive and quantitative update

Mandal, R., Guo, A. C., Chaudhary, K. K., Liu, P., Yallou, F. S., Dong, E., Aziat, F., & Wishart, D. S. (2012) · Genome Medicine · doi:10.1186/gm337 · Cited by 150

Joint GC–MS and LC–MS platforms for comprehensive plant metabolomics: Repeatability and sample pre-treatment

t’Kindt, R., Morreel, K., Deforce, D. L. D., Boerjan, W., & Bocxlaer, J. V. (2009) · Journal of Chromatography B · doi:10.1016/j.jchromb.2009.08.041 · Cited by 149

Alkylation or Silylation for Analysis of Amino and Non-Amino Organic Acids by GC-MS?

Villas-Bôas, S. G., Smart, K. F., Sivakumaran, S., & Lane, G. A. (2011) · Metabolites · doi:10.3390/metabo1010003 · Cited by 148

Optimizing the Use of Quality Control Samples for Signal Drift Correction in Large-Scale Urine Metabolic Profiling Studies

Kamleh, M. A., Ebbels, T. M. D., Spagou, K., Masson, P., & Want, E. J. (2012) · Analytical Chemistry · doi:10.1021/ac202733q · Cited by 147

Separation strategies for untargeted metabolomics

Patti, G. J. (2011) · Journal of Separation Science · doi:10.1002/jssc.201100532 · Cited by 147

Metabonomic analysis of mouse urine by liquid-chromatography-time of flight mass spectrometry (LC-TOFMS): detection of strain, diurnal and gender differences

Plumb, R. S., Granger, J. H., Stumpf, C. L., Wilson, I. D., Evans, J. A., & Lenz, E. M. (2003) · The Analyst · doi:10.1039/b304296k · Cited by 146

Evaluation of a protocol for metabolic profiling studies on human blood plasma by combined ultra-performance liquid chromatography/mass spectrometry: From extraction to data analysis

Bruce, S. J., Jonsson, P., Antti, H., Cloarec, O., Trygg, J., Marklund, S. L., & Möritz, T. (2007) · Analytical Biochemistry · doi:10.1016/j.ab.2007.09.037 · Cited by 143

Combining desorption electrospray ionization mass spectrometry and nuclear magnetic resonance for differential metabolomics without sample preparation

Chen, H., Pan, Z., Talaty, N. N., Raftery, D., & Cooks, R. G. (2006) · Rapid Communications in Mass Spectrometry · doi:10.1002/rcm.2474 · Cited by 143

Metabolite analysis of human fecal water by gas chromatography/mass spectrometry with ethyl chloroformate derivatization

Gao, X., Pujos‐Guillot, E., Martin, J., Galan, P., Juste, C., Jia, W. P., & Sébédio, J. (2009) · Analytical Biochemistry · doi:10.1016/j.ab.2009.06.036 · Cited by 141

Multidimensional LC-LC and LC-CE for high-resolution separations of biological molecules

Evans, C. R., & Jorgenson, J. W. (2004) · Analytical and Bioanalytical Chemistry · doi:10.1007/s00216-004-2516-2 · Cited by 140

Metabolic profiling using direct infusion electrospray ionisation mass spectrometry for the characterisation of olive oils

Goodacre, R., Vaidyanathan, S., Bianchi, G., & Kell, D. B. (2002) · The Analyst · doi:10.1039/b206037j · Cited by 140

A GC-TOF-MS study of the stability of serum and urine metabolomes during the UK Biobank sample collection and preparation protocols

Dunn, W. B., Broadhurst, D., Ellis, D. I., Brown, M., Halsall, A., O’Hagan, S., Spasić, ‪., Tseng, A., & Kell, D. B. (2008) · International Journal of Epidemiology · doi:10.1093/ije/dym281 · Cited by 140

A multi-analytical platform approach to the metabonomic analysis of plasma from normal and zucker (fa/fa) obese rats

Williams, R. E., Lenz, E. M., Wilson, A., et al. (2006) · Molecular BioSystems · doi:10.1039/b516356k · Cited by 140

Quantitative metabolic profiling based on gas chromatography.

Gates, S. C., & Sweeley, C. C. (1978) · Clinical Chemistry · doi:10.1093/clinchem/24.10.1663 · Cited by 139

Virtual Quantification of Metabolites by Capillary Electrophoresis-Electrospray Ionization-Mass Spectrometry: Predicting Ionization Efficiency Without Chemical Standards

Chalcraft, K. R., Lee, R., Mills, C., & Britz‐McKibbin, P. (2009) · Analytical Chemistry · doi:10.1021/ac802272u · Cited by 139

Metabolic Differentiation of Neuronal Phenotypes by Single-cell Capillary Electrophoresis–Electrospray Ionization-Mass Spectrometry

Nemes, P., Knolhoff, A. M., Rubakhin, S. S., & Sweedler, J. V. (2011) · Analytical Chemistry · doi:10.1021/ac2015855 · Cited by 137

High-throughput, nontargeted metabolite fingerprinting using nominal mass flow injection electrospray mass spectrometry

Beckmann, M., Parker, D., Enot, D. P., Duval, E., & Draper, J. (2008) · Nature Protocols · doi:10.1038/nprot.2007.500 · Cited by 136

Comparison of the Practical Resolving Power of One- and Two-Dimensional High-Performance Liquid Chromatography Analysis of Metabolomic Samples

Stoll, D. R., Wang, X., & Carr, P. W. (2007) · Analytical Chemistry · doi:10.1021/ac701676b · Cited by 136

Characterization of The Human Tear Metabolome by LC–MS/MS

Chen, L., Zhou, L., Chan, E. C. Y., Neo, J. C. H., & Beuerman, R. W. (2011) · Journal of Proteome Research · doi:10.1021/pr2004874 · Cited by 134

Urinary Volatile Compounds as Biomarkers for Lung Cancer: A Proof of Principle Study Using Odor Signatures in Mouse Models of Lung Cancer

Matsumura, K., Opiekun, M. C., Oka, H., Vachani, A., Albelda, S. Μ., Yamazaki, K., & Beauchamp, G. K. (2010) · PLoS ONE · doi:10.1371/journal.pone.0008819 · Cited by 134

Annotation of the Human Adult Urinary Metabolome and Metabolite Identification Using Ultra High Performance Liquid Chromatography Coupled to a Linear Quadrupole Ion Trap-Orbitrap Mass Spectrometer

Roux, A., Xu, Y., Heilier, J.-F., Olivier, M., Ezan, É., Tabet, J., & Junot, C. (2012) · Analytical Chemistry · doi:10.1021/ac300829f · Cited by 133

Bioanalytical applications of solid-phase microextraction

Musteata, F. M., & Pawliszyn, J. B. (2006) · TrAC Trends in Analytical Chemistry · doi:10.1016/j.trac.2006.11.003 · Cited by 132

Hydrophilic interaction and reversed‐phase ultra‐performance liquid chromatography TOF‐MS for metabonomic analysis of Zucker rat urine

Gika, H., Theodoridis, G. A., & Wilson, I. D. (2008) · Journal of Separation Science · doi:10.1002/jssc.200700644 · Cited by 131

A Comprehensive Untargeted Metabonomic Analysis of Human Steatotic Liver Tissue by RP and HILIC Chromatography Coupled to Mass Spectrometry Reveals Important Metabolic Alterations

García‐Cañaveras, J. C., Donato, M. T., Castell, J. V., & Lahoz, A. (2011) · Journal of Proteome Research · doi:10.1021/pr200629p · Cited by 130

Variability Analysis of Human Plasma and Cerebral Spinal Fluid Reveals Statistical Significance of Changes in Mass Spectrometry-Based Metabolomics Data

Crews, B. O., Wikoff, W. R., Patti, G. J., Woo, H., Kalisiak, E., Heideker, J., & Siuzdak, G. E. (2009) · Analytical Chemistry · doi:10.1021/ac9014947 · Cited by 129

How Large Is the Metabolome? A Critical Analysis of Data Exchange Practices in Chemistry

Kind, T., Scholz, M., & Fiehn, O. (2009) · PLoS ONE · doi:10.1371/journal.pone.0005440 · Cited by 129

Enhancing the Coverage of the Urinary Metabolome by Sheathless Capillary Electrophoresis-Mass Spectrometry

Ramautar, R., Busnel, J., Deelder, A. M., & Mayboroda, O. A. (2011) · Analytical Chemistry · doi:10.1021/ac202407v · Cited by 129

Peer Reviewed: Micellar Electrokinetic Chromatography

Terabe, S. (2004) · Analytical Chemistry · doi:10.1021/ac0415859 · Cited by 128

Second-Tier Test for Quantification of Alloisoleucine and Branched-Chain Amino Acids in Dried Blood Spots to Improve Newborn Screening for Maple Syrup Urine Disease (MSUD)

Oglesbee, D., Sanders, K. A., Lacey, J. M., Magera, M. J., Casetta, B., Strauss, K. A., Tortorelli, S., Rinaldo, P., & Matern, D. (2008) · Clinical Chemistry · doi:10.1373/clinchem.2007.098434 · Cited by 128

Inter-laboratory reproducibility of fast gas chromatography–electron impact–time of flight mass spectrometry (GC–EI–TOF/MS) based plant metabolomics

Allwood, J. W., Erban, A., de Koning, S., Dunn, W. B., Luedemann, A., Lommen, A., Kay, L., Löscher, R., Kopka, J., & Goodacre, R. (2009) · Metabolomics · doi:10.1007/s11306-009-0169-z · Cited by 128

Mass Spectral Metabonomics beyond Elemental Formula: Chemical Database Querying by Matching Experimental with Computational Fragmentation Spectra

Hill, D. W., Kertesz, T. M., Fontaine, D., Friedman, R., & Grant, D. F. (2008) · Analytical Chemistry · doi:10.1021/ac800548g · Cited by 127

Data correction strategy for metabolomics analysis using gas chromatography–mass spectrometry

Kanani, H., & Klapa, M. I. (2006) · Metabolic Engineering · doi:10.1016/j.ymben.2006.08.001 · Cited by 123

Metabolomics demonstrates divergent responses of two Eucalyptus species to water stress

Warren, C. R., Aranda, I., & Cano, F. J. (2011) · Metabolomics · doi:10.1007/s11306-011-0299-y · Cited by 122

Hydrophilic Interaction Chromatography for Mass Spectrometric Metabonomic Studies of Urine

Cubbon, S., Bradbury, T., Wilson, J. C., & THOMAS‐OATES, J. E. (2007) · Analytical Chemistry · doi:10.1021/ac071008v · Cited by 122

Chiral Separations

Stalcup, A. M. (2010) · Annual Review of Analytical Chemistry · doi:10.1146/annurev.anchem.111808.073635 · Cited by 122

Cytochrome P450 testing for prescribing antipsychotics in adults with schizophrenia: systematic review and meta-analyses

Fleeman, N., Dundar, Y., Dickson, R., Jorgensen, A., Pushpakom, S. P., McLeod, C., Pirmohamed, M., & Walley, T. (2010) · The Pharmacogenomics Journal · doi:10.1038/tpj.2010.73 · Cited by 121

Cross-Platform Comparison of Caenorhabditis elegans Tissue Extraction Strategies for Comprehensive Metabolome Coverage

Geier, F. M., Want, E. J., Leroi, A. M., & Bundy, J. G. (2011) · Analytical Chemistry · doi:10.1021/ac2001109 · Cited by 118

Estimation of Kováts Retention Indices Using Group Contributions

Stein, S. E., Babushok, V. I., Brown, R. L., & Linstrom, P. J. (2007) · Journal of Chemical Information and Modeling · doi:10.1021/ci600548y · Cited by 117

Characterization of Isotopic Abundance Measurements in High Resolution FT-ICR and Orbitrap Mass Spectra for Improved Confidence of Metabolite Identification

Weber, R. J. M., Southam, A. D., Sommer, U., & Viant, M. R. (2011) · Analytical Chemistry · doi:10.1021/ac2001803 · Cited by 115

Metabolite profiling on apple volatile content based on solid phase microextraction and gas-chromatography time of flight mass spectrometry

Aprea, E., Gika, H., Carlin, S., Theodoridis, G. A., Vrhovšek, U., & Mattivi, F. (2011) · Journal of Chromatography A · doi:10.1016/j.chroma.2011.05.019 · Cited by 113

An inter-laboratory comparison demonstrates that [1H]-NMR metabolite fingerprinting is a robust technique for collaborative plant metabolomic data collection

Ward, J. L., Baker, J. M., Miller, S. J., Deborde, C., Maucourt, M. M., Biais, B., Rolin, D., Moing, A., Moco, S., Vervoort, J. J. M., et al. (2010) · Metabolomics · doi:10.1007/s11306-010-0200-4 · Cited by 111

Future of Liquid Chromatography–Mass Spectrometry in Metabolic Profiling and Metabolomic Studies for Biomarker Discovery

Metz, T., Zhang, Q., Page, J. S., Shen, Y., Callister, S., Jacobs, J., & Smith, R. D. (2007) · Biomarkers in Medicine · doi:10.2217/17520363.1.1.159 · Cited by 110

Strategy for Optimizing LC-MS Data Processing in Metabolomics: A Design of Experiments Approach

Eliasson, M., Rännar, S., Madsen, R. B., Donten, M., Marsden‐Edwards, E., Möritz, T., Shockcor, J. P., Johansson, E., & Trygg, J. (2012) · Analytical Chemistry · doi:10.1021/ac301482k · Cited by 108

Metabolomics Reveals Amino Acids Contribute to Variation in Response to Simvastatin Treatment

Trupp, M., Zhu, H., Wikoff, W. R., Baillie, R., Zeng, Z., Karp, P. D., Fiehn, O., Krauss, R. M., & Kaddurah‐Daouk, R. (2012) · PLoS ONE · doi:10.1371/journal.pone.0038386 · Cited by 107

Activity-Based Metabolomic Profiling of Enzymatic Function: Identification of Rv1248c as a Mycobacterial 2-Hydroxy-3-oxoadipate Synthase

de Carvalho, L. P. S., Zhao, H., Dickinson, C. E., Arango, N., Lima, C. D., Fischer, S. M., Ouerfelli, O., Nathan, C., & Rhee, K. Y. (2010) · Chemistry & Biology · doi:10.1016/j.chembiol.2010.03.009 · Cited by 107

Covering Chemical Diversity of Genetically-Modified Tomatoes Using Metabolomics for Objective Substantial Equivalence Assessment

Kusano, M., Redestig, H., Hirai, T., Oikawa, A., Matsuda, F., Fukushima, A., Arita, M., Watanabe, S., Yano, M., Hiwasa-Tanase, K., et al. (2011) · PLoS ONE · doi:10.1371/journal.pone.0016989 · Cited by 106

Review coupling of capillary electrochromatography to mass spectrometry

Klampfl, C. W. (2004) · Journal of Chromatography A · doi:10.1016/j.chroma.2004.04.072 · Cited by 104

Class selection of amino acid metabolites in body fluids using chemical derivatization and their enhanced 13 C NMR

Shanaiah, N., DeSilva, M. A., Gowda, G. A. N., Raftery, M. A., Hainline, B. E., & Raftery, D. (2007) · Proceedings of the National Academy of Sciences · doi:10.1073/pnas.0704449104 · Cited by 103

Capillary electrophoresis as a metabolomics tool for non-targeted fingerprinting of biological samples

Barbas, C., Moraes, E. P., & Villaseñor, A. (2011) · Journal of Pharmaceutical and Biomedical Analysis · doi:10.1016/j.jpba.2011.02.001 · Cited by 102

Mass spectrometry-based metabolomics applied to the chemical safety of food

Antignac, J., Courant, F., Pinel, G., Bichon, E., Monteau, F., Elliott, C. T., & Bizec, B. L. (2010) · TrAC Trends in Analytical Chemistry · doi:10.1016/j.trac.2010.11.003 · Cited by 102

Assessment of Compatibility between Extraction Methods for NMR- and LC/MS-Based Metabolomics

Beltran, A., Suárez, M., Rodriguez, M. A., Vinaixa, M., Samino, S., Arola, L., Correig, X., & Yanes, Ó. (2012) · Analytical Chemistry · doi:10.1021/ac3005567 · Cited by 101

NMR spectroscopy based metabonomic studies on the comparative biochemistry of the kidney and urine of the bank vole (Clethrionomys glareolus), wood mouse (Apodemus sylvaticus), white toothed shrew (Crocidura suaveolens) and the laboratory rat

Griffin, J. L., Walker, L. A., Garrod, S., et al. (2000) · Comparative Biochemistry and Physiology Part B Biochemistry and Molecular Biology · doi:10.1016/s0305-0491(00)00276-5 · Cited by 101

Metabolomics of transgenic maize combining Fourier transform-ion cyclotron resonance-mass spectrometry, capillary electrophoresis-mass spectrometry and pressurized liquid extraction

León, C., Rodríguez‐Meizoso, I., Lucio, M., García‐Cañas, V., Ibáñez, E., Schmitt‐Kopplin, P., & Cifuentes, A. (2009) · Journal of Chromatography A · doi:10.1016/j.chroma.2009.04.092 · Cited by 100

Integrative Metabolomics for Characterizing Unknown Low-Abundance Metabolites by Capillary Electrophoresis-Mass Spectrometry with Computer Simulations

Lee, R., Ptolemy, A. S., Niewczas, L., & Britz‐McKibbin, P. (2006) · Analytical Chemistry · doi:10.1021/ac061780i · Cited by 99

A reversed-phase capillary ultra-performance liquid chromatography–mass spectrometry (UPLC-MS) method for comprehensive top-down/bottom-up lipid profiling

Gao, X., Zhang, Q., Meng, D., Isaac, G., Zhao, R., Fillmore, T., Chu, R., Zhou, J., Tang, K., Hu, Z., et al. (2012) · Analytical and Bioanalytical Chemistry · doi:10.1007/s00216-012-5773-5 · Cited by 99

Phenotyping Tea Consumers by Nutrikinetic Analysis of Polyphenolic End-Metabolites

van Velzen, E. J. J., Westerhuis, J. A., van Duynhoven, J., van Dorsten, F. A., Grün, C. H., Jacobs, D. M., Duchateau, G. S. M. J. E., Vis, D. J., & Smilde, A. K. (2009) · Journal of Proteome Research · doi:10.1021/pr801071p · Cited by 98

Controlled Protein Precipitation in Combination with Chip-Based Nanospray Infusion Mass Spectrometry. An Approach for Metabolomics Profiling of Plasma

Boernsen, K. O., Gatzek, S., & Imbert, G. (2005) · Analytical Chemistry · doi:10.1021/ac0508604 · Cited by 97

Chemoselective probes for metabolite enrichment and profiling

Carlson, E. E., & Cravatt, B. F. (2007) · Nature Methods · doi:10.1038/nmeth1038 · Cited by 97

Analysis of nucleotides by pressure-assisted capillary electrophoresis–mass spectrometry using silanol mask technique

Soga, T., Ishikawa, T., Igarashi, S., Sugawara, K., Kakazu, Y., & Tomita, M. (2007) · Journal of Chromatography A · doi:10.1016/j.chroma.2007.05.054 · Cited by 95

What is a biomarker? Research investments and lack of clinical integration necessitate a review of biomarker terminology and validation schema

Ptolemy, A. S., & Rifai, N. (2010) · Scandinavian Journal of Clinical and Laboratory Investigation · doi:10.3109/00365513.2010.493354 · Cited by 94

A General, Positive Ion Mode ESI-MS Approach for the Analysis of Singly Charged Inorganic and Organic Anions Using a Dicationic Reagent

Soukup-Hein, R. J., Remsburg, J. W., Dasgupta, P. Κ., & Armstrong, D. W. (2007) · Analytical Chemistry · doi:10.1021/ac071102b · Cited by 93

A review of clinical diagnostic applications of liquid chromatography–tandem mass spectrometry

Shushan, B. I. (2010) · Mass Spectrometry Reviews · doi:10.1002/mas.20295 · Cited by 93

Development of Isotope Labeling LC–MS for Human Salivary Metabolomics and Application to Profiling Metabolome Changes Associated with Mild Cognitive Impairment

Zheng, J., Dixon, R. A., & Li, L. (2012) · Analytical Chemistry · doi:10.1021/ac3028307 · Cited by 92

Physiological and environmental parameters associated with mass spectrometry-based salivary metabolomic profiles

Sugimoto, M., Saruta, J., Matsuki, C., To, M., Onuma, H., Kaneko, M., Soga, T., Tomita, M., & Tsukinoki, K. (2012) · Metabolomics · doi:10.1007/s11306-012-0464-y · Cited by 91

Differential Volatile Signatures from Skin, Naevi and Melanoma: A Novel Approach to Detect a Pathological Process

Abaffy, T., DUNCAN, R. C., Riemer, D. D., Tietje, O., Elgart, G. W., Milikowski, C., & DeFazio, R. A. (2010) · PLoS ONE · doi:10.1371/journal.pone.0013813 · Cited by 89

Higher mass loadability in comprehensive two-dimensional gas chromatography–mass spectrometry for improved analytical performance in metabolomics analysis

Koek, M. M., Muilwijk, B., van Stee, L. L. P., & Hankemeier, T. (2007) · Journal of Chromatography A · doi:10.1016/j.chroma.2007.11.107 · Cited by 88

Nanoscale Ion-Pair Reversed-Phase HPLC−MS for Sensitive Metabolome Analysis

Kiefer, P., Delmotte, N., & Vorholt, J. A. (2010) · Analytical Chemistry · doi:10.1021/ac102445r · Cited by 88

Recent advances in sheathless interfacing of capillary electrophoresis and electrospray ionization mass spectrometry

Zamfir, A. D. (2007) · Journal of Chromatography A · doi:10.1016/j.chroma.2007.03.115 · Cited by 87

A metabonomic approach to the investigation of drug-induced phospholipidosis: an NMR spectroscopy and pattern recognition study

Nicholls, J. (2000) · Biomarkers · doi:10.1080/135475000750052420 · Cited by 87

ApplyingIn-SilicoRetention Index and Mass Spectra Matching for Identification of Unknown Metabolites in Accurate Mass GC-TOF Mass Spectrometry

Kumari, S., Stevens, D., Kind, T., Denkert, C., & Fiehn, O. (2011) · Analytical Chemistry · doi:10.1021/ac2006137 · Cited by 86

Semi-automated non-target processing in GC × GC–MS metabolomics analysis: applicability for biomedical studies

Koek, M. M., van der Kloet, F. M., Kleemann, R., Kooistra, T., Verheij, E. R., & Hankemeier, T. (2010) · Metabolomics · doi:10.1007/s11306-010-0219-6 · Cited by 86

Selectivity issues in targeted metabolomics: Separation of phosphorylated carbohydrate isomers by mixed‐mode hydrophilic interaction/weak anion exchange chromatography

Hinterwirth, H. H., Lämmerhofer, M., Preinerstorfer, B., Gargano, A., Reischl, R., Bicker, W., Trapp, O., Brecker, L., & Lindner, W. F. (2010) · Journal of Separation Science · doi:10.1002/jssc.201000412 · Cited by 86

Metabolomics Approach for Analyzing the Effects of Exercise in Subjects with Type 1 Diabetes Mellitus

Brugnara, L., Vinaixa, M., Murillo, S., Samino, S., Rodriguez, M. A., Beltran, A., Lerín, C., Davison, G. W., Correig, X., & Novials, A. (2012) · PLoS ONE · doi:10.1371/journal.pone.0040600 · Cited by 84

Method development in high-performance liquid chromatography for high-throughput profiling and metabonomic studies of biofluid samples

Pham‐Tuan, H., Kaskavelis, L., Daykin, C. A., & Janssen, H. (2003) · Journal of Chromatography B · doi:10.1016/s1570-0232(03)00077-1 · Cited by 84

High speed gradient elution reversed-phase liquid chromatography

Schellinger, A. P., Stoll, D. R., & Carr, P. W. (2005) · Journal of Chromatography A · doi:10.1016/j.chroma.2004.12.017 · Cited by 84

Metabolomics with LC-QTOF-MS Permits the Prediction of Disease Stage in Aortic Abdominal Aneurysm Based on Plasma Metabolic Fingerprint

Ciborowski, M., Teul, J., Martín-Ventura, J. L., Egido, J., & Barbas, C. (2012) · PLoS ONE · doi:10.1371/journal.pone.0031982 · Cited by 83

Fourier transform mass spectrometry for metabolome analysis

Junot, C., Madalinski, G., Tabet, J. C., & Ezan, É. (2010) · The Analyst · doi:10.1039/c0an00021c · Cited by 83

Separating the wheat from the chaff: a prioritisation pipeline for the analysis of metabolomics datasets

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Simultaneous Chemical and Sensory Characterization of Volatile Organic Compounds and Semi‐Volatile Organic Compounds Emitted from Swine Manure using Solid Phase Microextraction and Multidimensional Gas Chromatography–Mass Spectrometry–Olfactometry

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Assessment of Metabolome Annotation Quality: A Method for Evaluating the False Discovery Rate of Elemental Composition Searches

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Increased Serum Lipoprotein(a) Concentrations and Low Molecular Weight Phenotypes of Apolipoprotein(a) Are Associated with Symptomatic Peripheral Arterial Disease

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Design and Performance of a Universal Sheathless Capillary Electrophoresis to Mass Spectrometry Interface Using a Split-Flow Technique

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The Impact of Delayed Storage on the Measured Proteome and Metabolome of Human Cerebrospinal Fluid

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Evaluation of Sampling and Extraction Methodologies for the Global Metabolic Profiling ofSaccharophagus degradans

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The Riddle of Protein Diagnostics: Future Bleak or Bright?

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Comprehensive Plasma Thiol Redox Status Determination for Metabolomics

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High temperature-ultra performance liquid chromatography–mass spectrometry for the metabonomic analysis of Zucker rat urine

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Targeting the Human Genome–Microbiome Axis for Drug Discovery: Inspirations from Global Systems Biology and Traditional Chinese Medicine

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Ionizable Isotopic Labeling Reagent for Relative Quantification of Amine Metabolites by Mass Spectrometry

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Improved enantiomer resolution and quantification of free d-amino acids in serum and urine by comprehensive two-dimensional gas chromatography–time-of-flight mass spectrometry

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Determination of elemental compositions by gas chromatography/time‐of‐flight mass spectrometry using chemical and electron ionization

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Pressure-assisted capillary electrophoresis mass spectrometry using combination of polarity reversion and electroosmotic flow for metabolomics anion analysis

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GC-MS with ethyl chloroformate derivatization for comprehensive analysis of metabolites in serum and its application to human uremia

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Quantitative analysis of anionic metabolites for Catharanthus roseus by capillary electrophoresis using sulfonated capillary coupled with electrospray ionization-tandem mass spectrometry

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Metabolic profiling of human urine by CE-MS using a positively charged capillary coating and comparison with UPLC-MS

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Biomarker discovery in biological specimens (plasma, hair, liver and kidney) of diabetic mice based upon metabolite profiling using ultra-performance liquid chromatography with electrospray ionization time-of-flight mass spectrometry

Tsutsui, H., Maeda, T., Min, J. Z., Inagaki, S., Higashi, T., Kagawa, Y., & Toyo’oka, T. (2010) · Clinica Chimica Acta · doi:10.1016/j.cca.2010.12.023 · Cited by 55

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Analysis of Chiral Amino Acids in Conventional and Transgenic Maize

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Submicrometer Plate Heights for Capillaries Packed with Silica Colloidal Crystals

Malkin, D. S., Wei, B., Fogiel, A. J., Staats, S. L., & Wirth, M. J. (2010) · Analytical Chemistry · doi:10.1021/ac100062t · Cited by 53

Changing perspectives in yeast research nearly a decade after the genome sequencePreprint

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Untargeted Plasma Metabolite Profiling Reveals the Broad Systemic Consequences of Xanthine Oxidoreductase Inactivation in Mice

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Comparison of serum versus plasma collection in gas chromatography – Mass spectrometry‐based metabolomics

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Asymmetrical Emitter Geometries for Increased Range of Stable Electrospray Flow Rates

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Is metabolomics reachable? Different purification strategies of human colon cancer cells provide different CE‐MS metabolite profiles

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Enhancing the Power of Liquid Chromatography–Mass Spectrometry-Based Urine Metabolomics in Negative Ion Mode by Optimization of the Additive

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Is Urinary Sarcosine Useful to Identify Patients With Significant Prostate Cancer? The Trials and Tribulations of Biomarker Development

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Individual Metabolic Patterns, Alcoholism, Genetotrophic Diseases

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Characterization of Diet-Dependent Metabolic Serotypes: Primary Validation of Male and Female Serotypes in Independent Cohorts of Rats

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New insight into suction and dilution effects in CE coupled to MS via an ESI interface. II – Dilution effect

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Evaluation of High Resolution Magic-Angle Coil Spinning NMR Spectroscopy for Metabolic Profiling of Nanoliter Tissue Biopsies

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Nine Orders of Magnitude Dynamic Range: Picomolar to Millimolar Concentration Measurement in Capillary Electrophoresis with Laser Induced Fluorescence Detection Employing Cascaded Avalanche Photodiode Photon Counters

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Large-Scale Human Metabolic Phenotyping and Molecular Epidemiological Studies via 1H NMR Spectroscopy of Urine: Investigation of Borate Preservation

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LC–SPE–NMR–MS: A Total Analysis System for Bioanalysis

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Comprehensive Profiling of Free and Conjugated Estrogens by Capillary Electrophoresis–Time of Flight/Mass Spectrometry

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Chemical-Sensory Characterization of Dairy Manure Odor Using Headspace Solid-Phase Microextraction and Multidimensional Gas Chromatography Mass Spectrometry-Olfactometry

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Advantages of Tandem LC−MS for the Rapid Assessment of Tissue-Specific Metabolic Complexity Using a Pentafluorophenylpropyl Stationary Phase

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Capillary electrophoresis and small molecule drug discovery: a perfect match?

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Profiling the Anaerobic Response of C. elegans Using GC-MS

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Phosphonium labeling for increasing metabolomic coverage of neutral lipids using electrospray ionization mass spectrometry

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