Current state-of-the-art of separation methods used in LC-MS based metabolomics and lipidomics

Data sharing in PredRet for accurate prediction of retention time: Application to plant food bioactive compounds

(2021) Dorrain Yanwen Low et al.   FOOD CHEMISTRY

Current status of retention time prediction in metabolite identification

(2020) Michael Witting et al.   JOURNAL OF SEPARATION SCIENCE

QSRR Automator: A Tool for Automating Retention Time Prediction in Lipidomics and Metabolomics

(2020) Bradley C. Naylor et al.   Metabolites

Anion-exchange chromatography mass spectrometry provides extensive coverage of primary metabolic pathways revealing altered metabolism in IDH1 mutant cells

(2020) John Walsby-Tickle et al.   Communications Biology

Sensitive and Reproducible Mass Spectrometry-Compatible RP-UHPLC Analysis of Tricarboxylic Acid Cycle and Related Metabolites in Biological Fluids: Application to Human Urine

(2020) Kerri M. Smith et al.   ANALYTICAL CHEMISTRY

Capillary ultrahigh-pressure liquid chromatography-mass spectrometry for fast and high resolution metabolomics separations

(2020) Matthew J. Sorensen et al.   JOURNAL OF CHROMATOGRAPHY A

A scoring approach for multi-platform acquisition in metabolomics

(2019) Julian Pezzatti et al.   JOURNAL OF CHROMATOGRAPHY A

Development of a rapid profiling method for the analysis of polar analytes in urine using HILIC–MS and ion mobility enabled HILIC–MS

(2019) Adam M. King et al.   Metabolomics

Rational selection of reverse phase columns for high throughput LC–MS lipidomics

(2019) Angela Criscuolo et al.   CHEMISTRY AND PHYSICS OF LIPIDS

DecoMetDIA: Deconvolution of Multiplexed MS/MS Spectra for Metabolite Identification in SWATH-MS-Based Untargeted Metabolomics

(2019) Yandong Yin et al.   ANALYTICAL CHEMISTRY

Rapid profiling method for the analysis of lipids in human plasma using ion mobility enabled-reversed phase-ultra high performance liquid chromatography/mass spectrometry

(2019) Adam M King et al.   JOURNAL OF CHROMATOGRAPHY A

Nano-LC/NSI MS Refines Lipidomics by Enhancing Lipid Coverage, Measurement Sensitivity, and Linear Dynamic Range

(2018) Niklas Danne-Rasche et al.   ANALYTICAL CHEMISTRY

Untargeted profiling of Glycyrrhiza glabra extract with comprehensive two-dimensional liquid chromatography-mass spectrometry using multi-segmented shift gradients in the second dimension: Expanding the metabolic coverage

(2018) Yong Foo Wong et al.   ELECTROPHORESIS

Tandem HILIC-RP liquid chromatography for increased polarity coverage in food analysis

(2018) Daniel Hemmler et al.   ELECTROPHORESIS

Retention characteristics of some antibiotic and anti-retroviral compounds in hydrophilic interaction chromatography using isocratic elution, and gradient elution with repeatable partial equilibration

(2018) James C. Heaton et al.   ANALYTICA CHIMICA ACTA

Trace Phosphate Improves ZIC-pHILIC Peak Shape, Sensitivity, and Coverage for Untargeted Metabolomics

(2018) Jonathan L. Spalding et al.   JOURNAL OF PROTEOME RESEARCH

HMDB 4.0: the human metabolome database for 2018

(2017) David S Wishart et al.   NUCLEIC ACIDS RESEARCH

Genome-Wide Prediction of Metabolic Enzymes, Pathways, and Gene Clusters in Plants

(2017) Pascal Schläpfer et al.   PLANT PHYSIOLOGY

Evaluation of coverage, retention patterns, and selectivity of seven liquid chromatographic methods for metabolomics

(2016) Stefanie Wernisch et al.   ANALYTICAL AND BIOANALYTICAL CHEMISTRY

Development of a Rapid Microbore Metabolic Profiling Ultraperformance Liquid Chromatography–Mass Spectrometry Approach for High-Throughput Phenotyping Studies

(2016) Nicola Gray et al.   ANALYTICAL CHEMISTRY

Two-Dimensional Liquid Chromatography: A State of the Art Tutorial

(2016) Dwight R. Stoll et al.   ANALYTICAL CHEMISTRY

New on-line separation workflow of microbial metabolites via hyphenation of analytical and preparative comprehensive two-dimensional liquid chromatography

(2016) Xia Yan et al.   JOURNAL OF CHROMATOGRAPHY B-ANALYTICAL TECHNOLOGIES IN THE BIOMEDICAL AND LIFE SCIENCES

Continuous comprehensive two-dimensional liquid chromatography–electrospray ionization mass spectrometry of complex lipidomic samples

(2015) Michal Holčapek et al.   ANALYTICAL AND BIOANALYTICAL CHEMISTRY

PredRet: Prediction of Retention Time by Direct Mapping between Multiple Chromatographic Systems

(2015) Jan Stanstrup et al.   ANALYTICAL CHEMISTRY

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

(2015) Tomas Cajka et al.   ANALYTICAL CHEMISTRY

Computational analysis and ratiometric comparison approaches aimed to assist column selection in hydrophilic interaction liquid chromatography–tandem mass spectrometry targeted metabolomics

(2015) Ioannis Sampsonidis et al.   JOURNAL OF CHROMATOGRAPHY A

Fast separation and quantification of steroid hormones Δ4- and Δ7-dafachronic acid in Caenorhabditis elegans

(2015) Michael Witting et al.   JOURNAL OF CHROMATOGRAPHY B-ANALYTICAL TECHNOLOGIES IN THE BIOMEDICAL AND LIFE SCIENCES

Serially coupling hydrophobic interaction and reversed-phase chromatography with simultaneous gradients provides greater coverage of the metabolome

(2015) Jennifer Haggarty et al.   Metabolomics

Metabolomics Workbench: An international repository for metabolomics data and metadata, metabolite standards, protocols, tutorials and training, and analysis tools

(2015) Manish Sud et al.   NUCLEIC ACIDS RESEARCH

A versatile ultra-high performance LC-MS method for lipid profiling

(2014) Oskar L. Knittelfelder et al.   JOURNAL OF CHROMATOGRAPHY B-ANALYTICAL TECHNOLOGIES IN THE BIOMEDICAL AND LIFE SCIENCES

Annotation of the human serum metabolome by coupling three liquid chromatography methods to high-resolution mass spectrometry

(2014) Samia Boudah et al.   JOURNAL OF CHROMATOGRAPHY B-ANALYTICAL TECHNOLOGIES IN THE BIOMEDICAL AND LIFE SCIENCES

Lipid profiling of human plasma from peritoneal dialysis patients using an improved 2D (NP/RP) LC-QToF MS method

(2013) Min Li et al.   ANALYTICAL AND BIOANALYTICAL CHEMISTRY

Kinetic evaluation of new generation of column packed with 1.3μm core–shell particles

(2013) Szabolcs Fekete et al.   JOURNAL OF CHROMATOGRAPHY A

Pushing the performance limits of reversed-phase ultra high performance liquid chromatography with 1.3μm core–shell particles

(2013) A. Carl Sanchez et al.   JOURNAL OF CHROMATOGRAPHY A

A novel ion pairing LC/MS metabolomics protocol for study of a variety of biologically relevant polar metabolites

(2013) Jose M. Knee et al.   JOURNAL OF CHROMATOGRAPHY B-ANALYTICAL TECHNOLOGIES IN THE BIOMEDICAL AND LIFE SCIENCES

Serial coupling of reversed-phase and zwitterionic hydrophilic interaction LC/MS for the analysis of polar and nonpolar phenols in wine

(2013) Giorgia Greco et al.   JOURNAL OF SEPARATION SCIENCE

A positive/negative ion–switching, targeted mass spectrometry–based metabolomics platform for bodily fluids, cells, and fresh and fixed tissue

(2012) Min Yuan et al.   Nature Protocols

ECMDB: The E. coli Metabolome Database

(2012) An Chi Guo et al.   NUCLEIC ACIDS RESEARCH

MetaboLights—an open-access general-purpose repository for metabolomics studies and associated meta-data

(2012) Kenneth Haug et al.   NUCLEIC ACIDS RESEARCH

YMDB: the Yeast Metabolome Database

(2011) T. Jewison et al.   NUCLEIC ACIDS RESEARCH

Absolute metabolite concentrations and implied enzyme active site occupancy in Escherichia coli

(2009) Bryson D Bennett et al.   Nature Chemical Biology