Application of Predicted Collisional Cross Section to Metabolome Databases to Probabilistically Describe the Current and Future Ion Mobility Mass Spectrometry

Breaking Down Structural Diversity for Comprehensive Prediction of Ion-Neutral Collision Cross Sections

(2020) Dylan H. Ross et al.   ANALYTICAL CHEMISTRY

The exposome and health: Where chemistry meets biology

(2020) Roel Vermeulen et al.   SCIENCE

Tracking complex mixtures of chemicals in our changing environment

(2020) Beate I. Escher et al.   SCIENCE

A lipidome atlas in MS-DIAL 4

(2020) Hiroshi Tsugawa et al.   NATURE BIOTECHNOLOGY

Ion mobility collision cross-section atlas for known and unknown metabolite annotation in untargeted metabolomics

(2020) Zhiwei Zhou et al.   Nature Communications

Structure Annotation of All Mass Spectra in Untargeted Metabolomics

(2019) Ivana Blaženović et al.   ANALYTICAL CHEMISTRY

Use of ion mobility mass spectrometry to enhance cumulative analytical specificity and separation to profile 6‐ C /8‐ C‐ glycosylflavone critical isomer pairs and known–unknowns in medicinal plants

(2019) Michael McCullagh et al.   PHYTOCHEMICAL ANALYSIS

ISiCLE: A Quantum Chemistry Pipeline for Establishing in Silico Collision Cross Section Libraries

(2019) Sean M. Colby et al.   ANALYTICAL CHEMISTRY

Predicting Ion Mobility Collision Cross-Sections Using a Deep Neural Network: DeepCCS

(2019) Pier-Luc Plante et al.   ANALYTICAL CHEMISTRY

CHNOSZ: Thermodynamic Calculations and Diagrams for Geochemistry

(2019) Jeffrey M. Dick   Frontiers in Earth Science

Exploring the Complexity of Steviol Glycosides Analysis Using Ion Mobility Mass Spectrometry

(2018) Michael McCullagh et al.   ANALYTICAL CHEMISTRY

OUP accepted manuscript

(2018)   BIOINFORMATICS

Ion Mobility Mass Spectrometry of Saponin Ions

(2018) Corentin Decroo et al.   RAPID COMMUNICATIONS IN MASS SPECTROMETRY

Comprehensive Three-Dimensional LC × LC × Ion Mobility Spectrometry Separation Combined with High-Resolution MS for the Analysis of Complex Samples

(2018) Pieter Venter et al.   ANALYTICAL CHEMISTRY

Unraveling the isomeric heterogeneity of glycans: ion mobility separations in structures for lossless ion manipulations

(2018) Gabe Nagy et al.   CHEMICAL COMMUNICATIONS

Untargeted Molecular Discovery in Primary Metabolism: Collision Cross Section as a Molecular Descriptor in Ion Mobility-Mass Spectrometry

(2018) Charles M. Nichols et al.   ANALYTICAL CHEMISTRY

Investigations into the Performance of Travelling Wave‐Enabled Conventional and Cyclic Ion Mobility Systems to Characterise Protomers of Fluoroquinolone Antibiotic Residues

(2018) Michael McCullagh et al.   RAPID COMMUNICATIONS IN MASS SPECTROMETRY

Orthogonality measurements for multidimensional chromatography in three and higher dimensional separations

(2017) Mark R. Schure et al.   JOURNAL OF CHROMATOGRAPHY A

Comprehensive lipidomic analysis of human plasma using multidimensional liquid- and gas-phase separations: Two-dimensional liquid chromatography–mass spectrometry vs . liquid chromatography–trapped-ion-mobility–mass spectrometry

(2017) Anna Baglai et al.   JOURNAL OF CHROMATOGRAPHY A

HMDB 4.0: the human metabolome database for 2018

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

Uncovering biologically significant lipid isomers with liquid chromatography, ion mobility spectrometry and mass spectrometry

(2016) Jennifer E. Kyle et al.   ANALYST

Large-Scale Prediction of Collision Cross-Section Values for Metabolites in Ion Mobility-Mass Spectrometry

(2016) Zhiwei Zhou et al.   ANALYTICAL CHEMISTRY

Accelerated Isotope Fine Structure Calculation Using Pruned Transition Trees

(2015) Martin Loos et al.   ANALYTICAL CHEMISTRY

Theoretical evaluation of peak capacity improvements by use of liquid chromatography combined with drift tube ion mobility-mass spectrometry

(2015) Tim J. Causon et al.   JOURNAL OF CHROMATOGRAPHY A

A new measure of orthogonality for multi-dimensional chromatography

(2014) Michelle Camenzuli et al.   ANALYTICA CHIMICA ACTA

Ion Mobility-Derived Collision Cross Section As an Additional Measure for Lipid Fingerprinting and Identification

(2014) Giuseppe Paglia et al.   ANALYTICAL CHEMISTRY

Ion Trapping for Ion Mobility Spectrometry Measurements in a Cyclical Drift Tube

(2013) Rebecca S. Glaskin et al.   ANALYTICAL CHEMISTRY

An Ion Mobility Assisted Data Independent LC-MS Strategy for the Analysis of Complex Biological Samples

(2013) Eva Rodriguez-Suarez et al.   Current Analytical Chemistry

Separation of steroid isomers by ion mobility mass spectrometry

(2013) Linda Ahonen et al.   JOURNAL OF CHROMATOGRAPHY A

Baseline resolution of isomers by traveling wave ion mobility mass spectrometry: investigating the effects of polarizable drift gases and ionic charge distribution

(2013) Priscila M. Lalli et al.   JOURNAL OF MASS SPECTROMETRY

Ion Mobility Mass Spectrometry of Peptide Ions: Effects of Drift Gas and Calibration Strategies

(2012) Matthew F. Bush et al.   ANALYTICAL CHEMISTRY

Considerations in experimental and theoretical collision cross-section measurements of small molecules using travelling wave ion mobility spectrometry-mass spectrometry

(2009) Tom W. Knapman et al.   INTERNATIONAL JOURNAL OF MASS SPECTROMETRY