Search Results - "Tautenhahn, Ralf"
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Highly sensitive feature detection for high resolution LC/MS
Published in BMC bioinformatics (28-11-2008)“…Liquid chromatography coupled to mass spectrometry (LC/MS) is an important analytical technology for e.g. metabolomics experiments. Determining the boundaries,…”
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XCMS Online: A Web-Based Platform to Process Untargeted Metabolomic Data
Published in Analytical chemistry (Washington) (05-06-2012)“…Recently, interest in untargeted metabolomics has become prevalent in the general scientific community among an increasing number of investigators. The…”
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CAMERA: An Integrated Strategy for Compound Spectra Extraction and Annotation of Liquid Chromatography/Mass Spectrometry Data Sets
Published in Analytical chemistry (Washington) (03-01-2012)“…Liquid chromatography coupled to mass spectrometry is routinely used for metabolomics experiments. In contrast to the fairly routine and automated data…”
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An accelerated workflow for untargeted metabolomics using the METLIN database
Published in Nature biotechnology (01-09-2012)“…Metabolites, which are typically recognized as small molecules that are involved in cellular reactions, provide a functional signature of phenotype that is…”
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Meta-analysis of untargeted metabolomic data from multiple profiling experiments
Published in Nature protocols (01-03-2012)“…metaXCMS is a software program for the analysis of liquid chromatography/mass spectrometry–based untargeted metabolomic data. It is designed to identify the…”
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The metabolome of induced pluripotent stem cells reveals metabolic changes occurring in somatic cell reprogramming
Published in Cell research (01-01-2012)“…Metabolism is vital to every aspect of cell function, yet the metabolome of induced pluripotent stem cells (iPSCs) remains largely unexplored. Here we report,…”
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Expanding Coverage of the Metabolome for Global Metabolite Profiling
Published in Analytical chemistry (Washington) (15-03-2011)“…Mass spectrometry-based metabolomics is the comprehensive study of naturally occurring small molecules collectively known as the metabolome. Given the vast…”
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Critical assessment of alignment procedures for LC-MS proteomics and metabolomics measurements
Published in BMC bioinformatics (15-09-2008)“…Liquid chromatography coupled to mass spectrometry (LC-MS) has become a prominent tool for the analysis of complex proteomics and metabolomics samples. In many…”
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Toward ‘Omic Scale Metabolite Profiling: A Dual Separation–Mass Spectrometry Approach for Coverage of Lipid and Central Carbon Metabolism
Published in Analytical chemistry (Washington) (16-07-2013)“…Although the objective of any ‘omic science is broad measurement of its constituents, such coverage has been challenging in metabolomics because the metabolome…”
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Autonomous Metabolomics for Rapid Metabolite Identification in Global Profiling
Published in Analytical chemistry (Washington) (20-01-2015)“…An autonomous metabolomic workflow combining mass spectrometry analysis with tandem mass spectrometry data acquisition was designed to allow for simultaneous…”
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Metabolomics implicates altered sphingolipids in chronic pain of neuropathic origin
Published in Nature chemical biology (22-01-2012)“…Untargeted metabolomics reveals a dysregulation of sphingolipid production during neuropathic pain exemplified by N , N -dimethylsphingosine, whose…”
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An Untargeted Metabolomic Workflow to Improve Structural Characterization of Metabolites
Published in Analytical chemistry (Washington) (20-08-2013)“…Mass spectrometry-based metabolomics relies on MS2 data for structural characterization of metabolites. To obtain the high-quality MS2 data necessary to…”
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A View from Above: Cloud Plots to Visualize Global Metabolomic Data
Published in Analytical chemistry (Washington) (15-01-2013)“…Global metabolomics describes the comprehensive analysis of small molecules in a biological system without bias. With mass spectrometry-based methods, global…”
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Arteriovenous Blood Metabolomics: A Readout of Intra-Tissue Metabostasis
Published in Scientific reports (05-08-2015)“…The human circulatory system consists of arterial blood that delivers nutrients to tissues and venous blood that removes the metabolic by-products. Although it…”
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metaXCMS: Second-Order Analysis of Untargeted Metabolomics Data
Published in Analytical chemistry (Washington) (01-02-2011)“…Mass spectrometry-based untargeted metabolomics often results in the observation of hundreds to thousands of features that are differentially regulated between…”
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Influence of Mass Resolving Power in Orbital Ion-Trap Mass Spectrometry-Based Metabolomics
Published in Analytical chemistry (Washington) (06-12-2016)“…Modern separation methods in conjunction with high-resolution accurate mass (HRAM) spectrometry can provide an enormous number of features characterized by…”
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Massifquant: open-source Kalman filter-based XC-MS isotope trace feature detection
Published in Bioinformatics (Oxford, England) (15-09-2014)“…Isotope trace (IT) detection is a fundamental step for liquid or gas chromatography mass spectrometry (XC-MS) data analysis that faces a multitude of technical…”
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Meta-Analysis of Untargeted Metabolomic Data: Combining Results from Multiple Profiling Experiments
Published in Nature protocols (16-02-2012)“…metaXCMS is a software program for the analysis of liquid chromatography/mass spectrometry-based untargeted metabolomic data that is designed to identify…”
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Meta-analysis of global metabolomic data identifies metabolites associated with life-span extension
Published in Metabolomics (01-08-2014)“…The manipulation of distinct signaling pathways and transcription factors has been shown to influence life span in a cell-non-autonomous manner in…”
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Determining conserved metabolic biomarkers from a million database queries
Published in Bioinformatics (Oxford, England) (01-12-2015)“…Metabolite databases provide a unique window into metabolome research allowing the most commonly searched biomarkers to be catalogued. Omic scale metabolite…”
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