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Development of a Robust and Repeatable UPLC−MS Method for the Long-Term Metabolomic Study of Human Serum

Analytical chemistry (Washington), 2009-02, Vol.81 (4), p.1357-1364

2009

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Deorphanizing solute carriers in Saccharomyces cerevisiae for secondary uptake of xenobiotic compounds

Frontiers in microbiology, 2024, Vol.15, p.1376653-1376653

2024

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Exploiting genomic knowledge in optimising molecular breeding programmes: algorithms from evolutionary computing

PloS one, 2012-11, Vol.7 (11), p.e48862-e48862

2012

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Structural Similarities between Some Common Fluorophores Used in Biology, Marketed Drugs, Endogenous Metabolites, and Natural Products

Marine drugs, 2020-11, Vol.18 (11), p.582

2020

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Analysing and Navigating Natural Products Space for Generating Small, Diverse, But Representative Chemical Libraries

Biotechnology journal, 2018-01, Vol.13 (1), p.n/a

2018

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The role and robustness of the Gini coefficient as an unbiased tool for the selection of Gini genes for normalising expression profiling data

Scientific reports, 2019-11, Vol.9 (1), p.17960-21, Article 17960

2019

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An untargeted metabolomics strategy to measure differences in metabolite uptake and excretion by mammalian cell lines

Metabolomics, 2020-10, Vol.16 (10), p.107-107, Article 107

2020

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The apparent permeabilities of Caco-2 cells to marketed drugs: magnitude, and independence from both biophysical properties and endogenite similarities

PeerJ (San Francisco, CA), 2015-11, Vol.3, p.e1405-e1405, Article e1405

2015

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Analysis of drug–endogenous human metabolite similarities in terms of their maximum common substructures

Journal of cheminformatics, 2017-03, Vol.9 (1), p.18-18, Article 18

2017

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Illuminating disease and enlightening biomedicine: Raman spectroscopy as a diagnostic tool

Analyst (London), 2013-07, Vol.138 (14), p.3871-3884

2013

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A palette of fluorophores that are differentially accumulated by wild-type and mutant strains of Escherichia coli : surrogate ligands for profiling bacterial membrane transporters

Microbiology (Society for General Microbiology), 2021-02, Vol.167 (2)

2021

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A ‘rule of 0.5’ for the metabolite-likeness of approved pharmaceutical drugs

Metabolomics, 2015-04, Vol.11 (2), p.323-339

2015

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GeneGini: Assessment via the Gini Coefficient of Reference “Housekeeping” Genes and Diverse Human Transporter Expression Profiles

Cell systems, 2018-02, Vol.6 (2), p.230-244.e1

2018

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Erratum to: A ‘rule of 0.5’ for the metabolite-likeness of approved pharmaceutical drugs

Metabolomics, 2015-04, Vol.11 (2), p.340-340

2015

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Understanding the foundations of the structural similarities between marketed drugs and endogenous human metabolites

Frontiers in pharmacology, 2015-05, Vol.6, p.105-105

2015

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Enhancing Drug Efficacy and Therapeutic Index through Cheminformatics-Based Selection of Small Molecule Binary Weapons That Improve Transporter-Mediated Targeting: A Cytotoxicity System Based on Gemcitabine

Frontiers in pharmacology, 2017-03, Vol.8, p.155

2017

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A metabolome pipeline: from concept to data to knowledge

Metabolomics, 2005-03, Vol.1 (1), p.39-51

2005

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Closed-Loop, Multiobjective Optimization of Two-Dimensional Gas Chromatography/Mass Spectrometry for Serum Metabolomics

Analytical chemistry (Washington), 2007-01, Vol.79 (2), p.464-476

2007

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Closed-Loop, Multiobjective Optimization of Analytical Instrumentation: Gas Chromatography/Time-of-Flight Mass Spectrometry of the Metabolomes of Human Serum and of Yeast Fermentations

Analytical chemistry (Washington), 2005-01, Vol.77 (1), p.290-303

2005

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Consensus rank orderings of molecular fingerprints illustrate the most genuine similarities between marketed drugs and small endogenous human metabolites, but highlight exogenous natural products as the most important ‘natural’ drug transporter substrates

ADMET & DMPK, 2017-06, Vol.5 (2), p.85-125

2017

Volltextzugriff (PDF)

A metabolome pipeline: from concept to data to knowledge

Metabolomics, 2005-03, Vol.1 (1), p.39-51

2005

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Direct infusion electrospray ionization mass spectra of crude cell extracts for microbial characterizations: influence of solvent conditions on the detection of proteins

Rapid communications in mass spectrometry, 2006-01, Vol.20 (1), p.21-30

2006

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Development of a Robust and Repeatable UPLC−MS Method for the Long-Term Metabolomic Study of Human Serum

Deorphanizing solute carriers in Saccharomyces cerevisiae for secondary uptake of xenobiotic compounds

Exploiting genomic knowledge in optimising molecular breeding programmes: algorithms from evolutionary computing

Structural Similarities between Some Common Fluorophores Used in Biology, Marketed Drugs, Endogenous Metabolites, and Natural Products

Analysing and Navigating Natural Products Space for Generating Small, Diverse, But Representative Chemical Libraries

The role and robustness of the Gini coefficient as an unbiased tool for the selection of Gini genes for normalising expression profiling data

An untargeted metabolomics strategy to measure differences in metabolite uptake and excretion by mammalian cell lines

The apparent permeabilities of Caco-2 cells to marketed drugs: magnitude, and independence from both biophysical properties and endogenite similarities

Analysis of drug–endogenous human metabolite similarities in terms of their maximum common substructures

Illuminating disease and enlightening biomedicine: Raman spectroscopy as a diagnostic tool

A palette of fluorophores that are differentially accumulated by wild-type and mutant strains of Escherichia coli : surrogate ligands for profiling bacterial membrane transporters

Molecular phenotyping of a UK population: defining the human serum metabolome

COordination of Standards in MetabOlomicS (COSMOS): facilitating integrated metabolomics data access

A ‘rule of 0.5’ for the metabolite-likeness of approved pharmaceutical drugs

GeneGini: Assessment via the Gini Coefficient of Reference “Housekeeping” Genes and Diverse Human Transporter Expression Profiles

Erratum to: A ‘rule of 0.5’ for the metabolite-likeness of approved pharmaceutical drugs

Understanding the foundations of the structural similarities between marketed drugs and endogenous human metabolites

Enhancing Drug Efficacy and Therapeutic Index through Cheminformatics-Based Selection of Small Molecule Binary Weapons That Improve Transporter-Mediated Targeting: A Cytotoxicity System Based on Gemcitabine

A metabolome pipeline: from concept to data to knowledge

Closed-Loop, Multiobjective Optimization of Two-Dimensional Gas Chromatography/Mass Spectrometry for Serum Metabolomics

Closed-Loop, Multiobjective Optimization of Analytical Instrumentation: Gas Chromatography/Time-of-Flight Mass Spectrometry of the Metabolomes of Human Serum and of Yeast Fermentations

Erratum to: COordination of Standards in MetabOlomicS (COSMOS): facilitating integrated metabolomics data access

Consensus rank orderings of molecular fingerprints illustrate the most genuine similarities between marketed drugs and small endogenous human metabolites, but highlight exogenous natural products as the most important ‘natural’ drug transporter substrates

A metabolome pipeline: from concept to data to knowledge

Direct infusion electrospray ionization mass spectra of crude cell extracts for microbial characterizations: influence of solvent conditions on the detection of proteins

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