Chemometrics for ion mobility spectrometry data: recent advances and future prospects (Q36109592)

12 August 2017

Chemometrics for ion mobility spectrometry data: recent advances and future prospects (English)

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12 August 2017

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3

Lutgarde M C Buydens

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author name string

Ewa Szymańska

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1

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PubMed ID

27549384

12 August 2017

Antony N Davies

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2

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12 August 2017

23 August 2016

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12 August 2017

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12 August 2017

141

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12 August 2017

20

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12 August 2017

5689-5708

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Review on ion mobility spectrometry. Part 2: hyphenated methods and effects of experimental parameters.

12 August 2017

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Ion Mobility in Clinical Analysis: Current Progress and Future Perspectives.

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Ion mobility-mass spectrometry: time-dispersive instrumentation

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Ion mobility spectrometry: A personal view of its development at UCSB

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Developing liquid chromatography ion mobility mass spectometry techniques

21 January 2018

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Three-dimensional ion mobility/TOFMS analysis of electrosprayed biomolecules

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Recent developments in liquid chromatography-mass spectrometry and related techniques

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Systems-Wide High-Dimensional Data Acquisition and Informatics Using Structural Mass Spectrometry Strategies

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Review of chemometric analysis techniques for comprehensive two dimensional separations data

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Data size reduction strategy for the classification of breath and air samples using multicapillary column-ion mobility spectrometry

21 January 2018

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ESI/Ion Trap/Ion Mobility/Time-of-Flight Mass Spectrometry for Rapid and Sensitive Analysis of Biomolecular Mixtures

21 January 2018

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Collision cross sections of proteins and their complexes: a calibration framework and database for gas-phase structural biology

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Increasing conclusiveness of metabonomic studies by chem-informatic preprocessing of capillary electrophoretic data on urinary nucleoside profiles

21 January 2018

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Simple and Effective Way for Data Preprocessing Selection Based on Design of Experiments

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Detection of methamphetamine in the presence of nicotine using in situ chemical derivatization and ion mobility spectrometry

21 January 2018

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Detection of cocaine and its metabolites in urine using solid phase extraction-ion mobility spectrometry with alternating least squares

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Efficient recovery of electrophoretic profiles of nucleoside metabolites from urine samples by multivariate curve resolution.

21 January 2018

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Multivariate Curve Resolution (MCR) from 2000: Progress in Concepts and Applications

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Quantitative analysis of morphine and noscapine using corona discharge ion mobility spectrometry with ammonia reagent gas.

21 January 2018

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Two-dimensional nonlinear wavelet compression of ion mobility spectra of chemical warfare agent simulants

21 January 2018

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Nonlinear wavelet compression of ion mobility spectra from ion mobility spectrometers mounted in an unmanned aerial vehicle

21 January 2018

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Increasing conclusiveness of clinical breath analysis by improved baseline correction of multi capillary column - ion mobility spectrometry (MCC-IMS) data

21 January 2018

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Direct coupling of a gas-liquid separator to an ion mobility spectrometer for the classification of different white wines using chemometrics tools.

21 January 2018

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Discrimination of bacteria using pyrolysis-gas chromatography-differential mobility spectrometry (Py-GC-DMS) and chemometrics.

21 January 2018

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Delineating diseases by IMS-MS profiling of serum N-linked glycans

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An online peak extraction algorithm for ion mobility spectrometry data.

21 January 2018

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Alpha-gliadin genes from the A, B, and D genomes of wheat contain different sets of celiac disease epitopes

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Conformational ordering of biomolecules in the gas phase: nitrogen collision cross sections measured on a prototype high resolution drift tube ion mobility-mass spectrometer.

21 January 2018

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Metabolic Profiling of Human Blood by High Resolution Ion Mobility Mass Spectrometry (IM-MS).

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Lipid analysis and lipidomics by structurally selective ion mobility-mass spectrometry

21 January 2018

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Machine learning based prediction for peptide drift times in ion mobility spectrometry

21 January 2018

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Amphitrite: A program for processing travelling wave ion mobility mass spectrometry data

21 January 2018

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Chemometric data analysis for deconvolution of overlapped ion mobility profiles

21 January 2018

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Current breathomics--a review on data pre-processing techniques and machine learning in metabolomics breath analysis

21 January 2018

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Computational methods for metabolomic data analysis of ion mobility spectrometry data-reviewing the state of the art.

21 January 2018

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Peak detection method evaluation for ion mobility spectrometry by using machine learning approaches

21 January 2018

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Alignment of retention time obtained from multicapillary column gas chromatography used for VOC analysis with ion mobility spectrometry

21 January 2018

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Alignment for comprehensive two-dimensional gas chromatography with dual secondary columns and detectors

21 January 2018

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Optimization of a liquid chromatography ion mobility-mass spectrometry method for untargeted metabolomics using experimental design and multivariate data analysis.

21 January 2018

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LC-IMS-MS Feature Finder: detecting multidimensional liquid chromatography, ion mobility and mass spectrometry features in complex datasets

21 January 2018

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Advancing the high throughput identification of liver fibrosis protein signatures using multiplexed ion mobility spectrometry

21 January 2018

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Analytical advantages of multivariate data processing. One, two, three, infinity?

21 January 2018

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Direct classification of olive oils by using two types of ion mobility spectrometers

21 January 2018

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Mapping Microbial Response Metabolomes for Induced Natural Product Discovery.

21 January 2018

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Carotta: Revealing Hidden Confounder Markers in Metabolic Breath Profiles

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Integrated statistical learning of metabolic ion mobility spectrometry profiles for pulmonary disease identification

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Rapid detection of sepsis in rats through volatile organic compounds in breath

21 January 2018

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Direct detection of trimethylamine in meat food products using ion mobility spectrometry

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Sparse PLS discriminant analysis: biologically relevant feature selection and graphical displays for multiclass problems

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A review of recent, unconventional applications of ion mobility spectrometry (IMS).

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Rapid analysis of tile industry gaseous emissions by ion mobility spectrometry and comparison with solid phase micro-extraction/gas chromatography/mass spectrometry.

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Determination of benzene, toluene and xylene concentration in humid air using differential ion mobility spectrometry and partial least squares regression

21 January 2018

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Double-check: validation of diagnostic statistics for PLS-DA models in metabolomics studies

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Ion mobility spectrometry for microbial volatile organic compounds: a new identification tool for human pathogenic bacteria

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Software for analysing ion mobility mass spectrometry data to improve peptide identification

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EM∩IM: software for relating ion mobility mass spectrometry and electron microscopy data

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Odor Assessment of Automobile Cabin Air With Field Asymmetric Ion Mobility Spectrometry and Photoionization Detection

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Toward Plasma Proteome Profiling with Ion Mobility-Mass Spectrometry

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Chemical standards for ion mobility spectrometry: a review

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Start-to-end processing of two-dimensional gel electrophoretic images

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Evaluation and application of static headspace–multicapillary column-gas chromatography–ion mobility spectrometry for complex sample analysis

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Non-invasive metabolomic analysis of breath using differential mobility spectrometry in patients with chronic obstructive pulmonary disease and healthy smokers

21 January 2018

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Breaking with trends in pre-processing?

21 January 2018

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Multi-capillary column-ion mobility spectrometry: a potential screening system to differentiate virgin olive oils

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Evaluation of different warping methods for the analysis of CE profiles of urinary nucleosides

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An Integrative Clinical Database and Diagnostics Platform for Biomarker Identification and Analysis in Ion Mobility Spectra of Human Exhaled Air.

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Ion mobility spectrometry fingerprints: A rapid detection technology for adulteration of sesame oil

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Hard modeling Multivariate Curve Resolution using LASSO: Application to Ion Mobility Spectra

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Improved detection of drugs of abuse using high-performance ion mobility spectrometry with electrospray ionization (ESI-HPIMS) for urine matrices

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Ion mobility-mass spectrometry analysis of serum N-linked glycans from esophageal adenocarcinoma phenotypes

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Ion mobility spectrometry for the detection of volatile organic compounds in exhaled breath of patients with lung cancer: results of a pilot study

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Multivariate curve resolution of nonlinear ion mobility spectra followed by multivariate nonlinear calibration for quantitative prediction

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Identifiers

DOI

10.1039/C6AN01008C

1 reference

12 August 2017

1 reference

PubMed ID

27549384