ERah: A Computational Tool Integrating Spectral Deconvolution and Alignment with Quantification and Identification of Metabolites in GC/MS-Based Metabolomics

Analytical Chemistry

Volumn 88, Issue 19, 2016, Pages 9821-9829

  Domingo Almenara, Xavier ^a,b   Brezmes, Jesus ^a,b   Vinaixa, Maria ^a,b   Samino, Sara ^a,b   Ramirez, Noelia ^a,b   Ramon Krauel, Marta ^c   Lerin, Carles ^c   Díaz, Marta ^b,c   Ibáñez, Lourdes ^b,c   Correig, Xavier ^a,b   Perera Lluna, Alexandre ^d   Yanes, Oscar ^a,b  

^a UNIVERSITAT ROVIRA I VIRGILI   (Spain)

^b INSTITUTO DE SALUD CARLOS III   (Spain)

^c UNIVERSITY OF BARCELONA   (Spain)

^d UNIVERSITAT POLITÈCNICA DE CATALUNYA   (Spain)

Author keywords

[No Author keywords available]

Indexed keywords

BIOMOLECULES; CHEMICAL ANALYSIS; CHROMATOGRAPHIC ANALYSIS; COMPUTATIONAL METHODS; DATA HANDLING; GAS CHROMATOGRAPHY; IONIZATION; IONIZATION OF GASES; MASS SPECTROMETERS; MASS SPECTROMETRY; METABOLITES; MULTIVARIANT ANALYSIS; ORTHOGONAL FUNCTIONS;

COMPUTATIONAL TOOLS; COMPUTATIONAL WORKFLOWS; ELECTRON IMPACT-IONIZATION; ELECTRON IONIZATION; MULTIVARIATE ANALYSIS TECHNIQUES; QUANTITATIVE INFORMATION; QUANTITATIVE RESULT; SPECTRAL DECONVOLUTION;

IMPACT IONIZATION;

ANDROGEN;

ADOLESCENT; ALGORITHM; BLOOD; HUMAN; HYPERINSULINISM; MASS FRAGMENTOGRAPHY; METABOLOMICS; MULTIVARIATE ANALYSIS; SOFTWARE;

ADOLESCENT; ALGORITHMS; ANDROGENS; GAS CHROMATOGRAPHY-MASS SPECTROMETRY; HUMANS; HYPERINSULINISM; METABOLOMICS; MULTIVARIATE ANALYSIS; SOFTWARE;

EID: 84989873472     PISSN: 00032700     EISSN: 15206882     Source Type: Journal    
DOI: 10.1021/acs.analchem.6b02927     Document Type: Article

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