Search Results - "Ebbels, Timothy M."
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Integrated pathway-level analysis of transcriptomics and metabolomics data with IMPaLA
Published in Bioinformatics (15-10-2011)“…Pathway-level analysis is a powerful approach enabling interpretation of post-genomic data at a higher level than that of individual biomolecules. Yet, it is…”
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Multiple-testing correction in metabolome-wide association studies
Published in BMC bioinformatics (12-02-2021)“…The search for statistically significant relationships between molecular markers and outcomes is challenging when dealing with high-dimensional, noisy and…”
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Bayesian deconvolution and quantification of metabolites in complex 1D NMR spectra using BATMAN
Published in Nature protocols (01-06-2014)“…BATMAN is an R package developed to analyze one-dimensional NMR spectra of complex metabolite mixtures using a user-defined template library. Data processing…”
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Reliability of plasma polar metabolite concentrations in a large-scale cohort study using capillary electrophoresis-mass spectrometry
Published in PloS one (18-01-2018)“…Cohort studies with metabolomics data are becoming more widespread, however, large-scale studies involving 10,000s of participants are still limited,…”
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Power Analysis and Sample Size Determination in Metabolic Phenotyping
Published in Analytical chemistry (Washington) (17-05-2016)“…Estimation of statistical power and sample size is a key aspect of experimental design. However, in metabolic phenotyping, there is currently no accepted…”
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BATMAN—an R package for the automated quantification of metabolites from nuclear magnetic resonance spectra using a Bayesian model
Published in Bioinformatics (01-08-2012)“…Nuclear Magnetic Resonance (NMR) spectra are widely used in metabolomics to obtain metabolite profiles in complex biological mixtures. Common methods used to…”
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Urinary metabolic signatures of human adiposity
Published in Science translational medicine (29-04-2015)“…Obesity is a major public health problem worldwide. We used 24-hour urinary metabolic profiling by proton ((1)H) nuclear magnetic resonance (NMR) spectroscopy…”
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Correction of mass calibration gaps in liquid chromatography–mass spectrometry metabolomics data
Published in Bioinformatics (01-10-2010)“…Motivation: High mass accuracy is an important goal in liquid chromatography–mass spectrometry experiments. Some manufacturers employ a mass calibration system…”
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Design and Analysis of Metabolomics Studies in Epidemiologic Research: A Primer on -Omic Technologies
Published in American journal of epidemiology (15-07-2014)“…Metabolomics is the field of "-omics" research concerned with the comprehensive characterization of the small low-molecular-weight metabolites in biological…”
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Single sample pathway analysis in metabolomics: performance evaluation and application
Published in BMC bioinformatics (14-11-2022)“…Single sample pathway analysis (ssPA) transforms molecular level omics data to the pathway level, enabling the discovery of patient-specific pathway…”
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Integrative analysis of time course metabolic data and biomarker discovery
Published in BMC bioinformatics (09-01-2020)“…Metabolomics time-course experiments provide the opportunity to understand the changes to an organism by observing the evolution of metabolic profiles in…”
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Predictive modelling using pathway scores: robustness and significance of pathway collections
Published in BMC bioinformatics (04-11-2019)“…Transcriptomic data is often used to build statistical models which are predictive of a given phenotype, such as disease status. Genes work together in…”
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Problems, principles and progress in computational annotation of NMR metabolomics data
Published in Metabolomics (05-12-2022)“…Background Compound identification remains a critical bottleneck in the process of exploiting Nuclear Magnetic Resonance (NMR) metabolomics data, especially…”
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Statistical analysis in metabolic phenotyping
Published in Nature protocols (01-09-2021)“…Metabolic phenotyping is an important tool in translational biomedical research. The advanced analytical technologies commonly used for phenotyping, including…”
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Optimizing the Use of Quality Control Samples for Signal Drift Correction in Large-Scale Urine Metabolic Profiling Studies
Published in Analytical chemistry (Washington) (20-03-2012)“…The evident importance of metabolic profiling for biomarker discovery and hypothesis generation has led to interest in incorporating this technique into…”
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Optimization and Evaluation of Metabolite Extraction Protocols for Untargeted Metabolic Profiling of Liver Samples by UPLC-MS
Published in Analytical chemistry (Washington) (15-09-2010)“…A series of six protocols were evaluated for UPLC-MS based untargeted metabolic profiling of liver extracts in terms of reproducibility and number of…”
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Optimized Preprocessing of Ultra-Performance Liquid Chromatography/Mass Spectrometry Urinary Metabolic Profiles for Improved Information Recovery
Published in Analytical chemistry (Washington) (01-08-2011)“…Ultra-performance liquid chromatography coupled to mass spectrometry (UPLC/MS) has been used increasingly for measuring changes of low molecular weight…”
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Use cases, best practice and reporting standards for metabolomics in regulatory toxicology
Published in Nature communications (10-07-2019)“…Metabolomics is a widely used technology in academic research, yet its application to regulatory science has been limited. The most commonly cited barrier to…”
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Statistical Correlations between NMR Spectroscopy and Direct Infusion FT-ICR Mass Spectrometry Aid Annotation of Unknowns in Metabolomics
Published in Analytical chemistry (Washington) (01-03-2016)“…NMR spectroscopy and mass spectrometry are the two major analytical platforms for metabolomics, and both generate substantial data with hundreds to thousands…”
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Metabolic profiling, metabolomic and metabonomic procedures for NMR spectroscopy of urine, plasma, serum and tissue extracts
Published in Nature protocols (01-11-2007)“…Metabolic profiling, metabolomic and metabonomic studies mainly involve the multicomponent analysis of biological fluids, tissue and cell extracts using NMR…”
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