Flow infusion electrospray ionisation mass spectrometry for high throughput, non-targeted metabolite fingerprinting: a review

Random Forests

Breiman, L. (2001) · Machine Learning · doi:10.1023/a:1010933404324 · Cited by 133,538

Metabolomics—the link between genotypes and phenotypes

Fiehn, O. (2002) · Plant Molecular Biology · doi:10.1023/a:1013713905833 · Cited by 3,445

Procedures for large-scale metabolic profiling of serum and plasma using gas chromatography and liquid chromatography coupled to mass spectrometry.

The Human Serum Metabolome (HUSERMET) Consortium, Dunn, W. B., Broadhurst, D., Begley, P., Zelena, E., Francis-McIntyre, S., Anderson, N., Brown, M., Knowles, J. D., Halsall, A., et al. (2011) · Nature Protocols · doi:10.1038/nprot.2011.335 · Cited by 3,294

Metabolomics — the link between genotypes and phenotypes

Fiehn, O. (2002) · Springer eBooks · doi:10.1007/978-94-010-0448-0_11 · Cited by 3,168

Centering, scaling, and transformations: improving the biological information content of metabolomics data

van den Berg, R. A., Hoefsloot, H. C., Westerhuis, J. A., Smilde, A. K., & van der Werf, M. J. (2006) · BMC Genomics · doi:10.1186/1471-2164-7-142 · Cited by 2,450

Mass spectrometry‐based metabolomics

Dettmer, K., Aronov, P. A., & Hammock, B. D. (2006) · Mass Spectrometry Reviews · doi:10.1002/mas.20108 · Cited by 2,379

Gas chromatography mass spectrometry–based metabolite profiling in plants

Lisec, J., Schauer, N., Kopka, J., Willmitzer, L., & Fernie, A. R. (2006) · Nature Protocols · doi:10.1038/nprot.2006.59 · Cited by 2,176

Ion Suppression in Mass Spectrometry

Annesley, T. M. (2003) · Clinical Chemistry · doi:10.1373/49.7.1041 · Cited by 1,598

Assessment of PLSDA Cross Validation

Westerhuis, J. A., Hoefsloot, H. C. J., Smit, S., Vis, D. J., Smilde, A. K., van Velzen, E. J. J., van Duijnhoven, J. P. M., & van Dorsten, F. A. (2008) · Metabolomics · doi:10.1007/s11306-007-0099-6 · Cited by 1,471

CAMERA: An Integrated Strategy for Compound Spectra Extraction and Annotation of Liquid Chromatography/Mass Spectrometry Data Sets

Kuhl, C., Tautenhahn, R., Böttcher, C., Larson, T. R., & Neumann, S. (2011) · Analytical Chemistry · doi:10.1021/ac202450g · Cited by 1,208

Toward Merging Untargeted and Targeted Methods in Mass Spectrometry-Based Metabolomics and Lipidomics

Čajka, T., & Fiehn, O. (2015) · Analytical Chemistry · doi:10.1021/acs.analchem.5b04491 · Cited by 839

Current approaches and challenges for the metabolite profiling of complex natural extracts

Wolfender, J.-L., Marti, G., Thomas, A., & Bertrand, S. (2015) · Journal of Chromatography A · doi:10.1016/j.chroma.2014.10.091 · Cited by 635

The food metabolome: a window over dietary exposure

Scalbert, A., Brennan, L., Manach, C., Andres-Lacueva, C., Dragsted, L. O., Draper, J., Rappaport, S. M., van der Hooft, J. J., & Wishart, D. S. (2014) · The American Journal of Clinical Nutrition · doi:10.3945/ajcn.113.076133 · Cited by 519

Abiotic Stress - Plant Responses and Applications in Agriculture

Vahdati, K., & Leslie, C. A. (2013) · InTech eBooks · doi:10.5772/45842 · Cited by 385

Accelerating Metabolite Identification in Natural Product Research: Toward an Ideal Combination of Liquid Chromatography–High-Resolution Tandem Mass Spectrometry and NMR Profiling, in Silico Databases, and Chemometrics

Wolfender, J., Nuzillard, J., van der Hooft, J. J. J., Renault, J., & Bertrand, S. (2018) · Analytical Chemistry · doi:10.1021/acs.analchem.8b05112 · Cited by 338

ORIGINAL ARTICLE Flow

Am, J. D., Beckmann, M., & Goodacre, R. (2013)

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

Automated work-flow for processing high-resolution direct infusion electrospray ionization mass spectral fingerprints

Hansen, M. A. E., & Smedsgaard, J. (2007) · Metabolomics · doi:10.1007/s11306-006-0044-0 · Cited by 10

A complete workflow for high-resolution spectral-stitching nanoelectrospray direct-infusion mass-spectrometry-based metabolomics and lipidomics

Southam, A. D., Weber, R. J. M., Engel, J., Jones, M. R., & Viant, M. R. (2017) · Nature Protocols · doi:10.1038/nprot.2016.156 · Cited by 168

Flow Infusion ESI High Resolution Mass Spectrometry Metabolomics Analytical Platforms

Wood, P. L. (2020) · Neuromethods · doi:10.1007/978-1-0716-0864-7_1 · Cited by 2

Metabolomic fingerprinting of serum samples by direct infusion mass spectrometry

González‐Domínguez, R. (2016) · International Electronic Conference on Metabolomics (IECM) · doi:10.3390/iecm-1-c001 · Cited by 2

Fast and sensitive flow-injection mass spectrometry metabolomics by analyzing sample-specific ion distributions

Sarvin, B. A., Lagziel, S., Sarvin, N., Mukha, D., Kumar, P., Aizenshtein, E., & Shlomi, T. (2020) · Nature Communications · doi:10.1038/s41467-020-17026-6 · Cited by 80

Serum metabolic profiling study of endometriosis by using wooden-tip electrospray ionization mass spectrometry

Yang, B., Liu, F., Wang, L., Zou, Y., Wang, F., Deng, W., Wan, X., Yang, X., He, M. L., & Huang, O. (2015) · Analytical Methods · doi:10.1039/c5ay01312g · Cited by 24

Preprocessing, classification modeling and feature selection using flow injection electrospray mass spectrometry metabolite fingerprint data

Enot, D. P., Lin, W., Beckmann, M., Parker, D., Overy, D. P., & Draper, J. (2008) · Nature Protocols · doi:10.1038/nprot.2007.511 · Cited by 114

Development of a standard protocol for high-throughput metabolomic fingerprinting of biofluids using FIA- and Nano-ESI coupled with FT-ICR MS

Xue, B., Alvès, S., Fenaille, F., Colsh, B., Tabet, J., Cole, R. B., Paris, A., Junot, C., & Rathahao, E. (2014) · HAL