Multivariate Curve Resolution-Alternating Least Squares Analysis of High-Resolution Liquid Chromatography–Mass Spectrometry Data

Curve Resolution ◽

Exploring in vivo violacein biosynthesis by application of multivariate curve resolution on fused UV–VIS absorption, fluorescence, and liquid chromatography–mass spectrometry data

Analytical and Bioanalytical Chemistry ◽

10.1007/s00216-012-6507-4 ◽

2012 ◽

Vol 405 (4) ◽

pp. 1293-1302 ◽

Cited By ~ 8

Author(s):

Clecio Dantas ◽

Romà Tauler ◽

Márcia Miguel Castro Ferreira

Keyword(s):

Mass Spectrometry ◽

Liquid Chromatography ◽

Mass Spectrometry Data ◽

Curve Resolution ◽

Analysis of Liquid Chromatography–Mass Spectrometry Data with an Elastic Net Multivariate Curve Resolution Strategy for Sparse Spectral Recovery

Analytical Chemistry ◽

10.1021/acs.analchem.7b01832 ◽

2017 ◽

Vol 89 (16) ◽

pp. 8405-8412 ◽

Cited By ~ 16

Author(s):

Daniel W. Cook ◽

Sarah C. Rutan

Keyword(s):

Mass Spectrometry ◽

Liquid Chromatography ◽

Elastic Net ◽

Mass Spectrometry Data ◽

Curve Resolution ◽

Spectral Recovery ◽

Resolution Strategy

Multivariate curve resolution modeling of liquid chromatography–mass spectrometry data in a comparative study of the different endogenous metabolites behavior in two tomato cultivars treated with carbofuran pesticide

Talanta ◽

10.1016/j.talanta.2011.03.064 ◽

2011 ◽

Vol 85 (1) ◽

pp. 264-275 ◽

Cited By ~ 16

Author(s):

Gabriel G. Siano ◽

Isidro Sánchez Pérez ◽

María D. Gil García ◽

María Martínez Galera ◽

Héctor C. Goicoechea

Keyword(s):

Mass Spectrometry ◽

Liquid Chromatography ◽

Comparative Study ◽

Mass Spectrometry Data ◽

Curve Resolution ◽

Tomato Cultivars ◽

Endogenous Metabolites

Automatic peak detection coupled with multivariate curve resolution–alternating least squares for peak resolution in gas chromatography–mass spectrometry

Journal of Chromatography A ◽

10.1016/j.chroma.2019.04.065 ◽

2019 ◽

Vol 1601 ◽

pp. 300-309 ◽

Cited By ~ 5

Author(s):

Yue-Ming Zhang ◽

Yu-Ying Zhang ◽

Qian Zhang ◽

Yi Lv ◽

Tao Sun ◽

...

Keyword(s):

Mass Spectrometry ◽

Gas Chromatography ◽

Least Squares ◽

Peak Detection ◽

Alternating Least Squares ◽

Gas Chromatography Mass Spectrometry ◽

Curve Resolution ◽

Peak Resolution

Least squares spectral resolution of liquid chromatography–mass spectrometry data of glycerophospholipids

Journal of Chromatography A ◽

10.1016/j.chroma.2012.12.070 ◽

2013 ◽

Vol 1280 ◽

pp. 23-34 ◽

Cited By ~ 4

Author(s):

Ying-Xu Zeng ◽

Svein A. Mjøs ◽

Sonnich Meier ◽

Chen-Chen Lin ◽

Reidun Vadla

Keyword(s):

Mass Spectrometry ◽

Liquid Chromatography ◽

Least Squares ◽

Spectral Resolution ◽

Mass Spectrometry Data ◽

Resolution and identification of co-eluting alkylphenols in comprehensive two-dimensional gas chromatography-mass spectrometry by multivariate curve resolution-alternating least squares

Journal of Chemometrics ◽

10.1002/cem.2701 ◽

2015 ◽

Vol 29 (4) ◽

pp. 237-244 ◽

Cited By ~ 3

Author(s):

Jone Omar ◽

Asier Vallejo ◽

Maitane Olivares ◽

Aresatz Usobiaga ◽

Olatz Zuloaga ◽

...

Keyword(s):

Mass Spectrometry ◽

Gas Chromatography ◽

Least Squares ◽

Alternating Least Squares ◽

Gas Chromatography Mass Spectrometry ◽

Two Dimensional ◽

Curve Resolution ◽

Solving liquid chromatography mass spectrometry coelution problems in the analysis of environmental samples by multivariate curve resolution

Journal of Chromatography A ◽

10.1016/j.chroma.2005.04.089 ◽

2005 ◽

Vol 1096 (1-2) ◽

pp. 111-122 ◽

Cited By ~ 62

Author(s):

Emma Peré-Trepat ◽

Silvia Lacorte ◽

Romà Tauler

Keyword(s):

Mass Spectrometry ◽

Liquid Chromatography ◽

Environmental Samples ◽

Curve Resolution ◽

A new approach to untargeted integration of high resolution liquid chromatography–mass spectrometry data

Analytica Chimica Acta ◽

10.1016/j.aca.2013.09.028 ◽

2013 ◽

Vol 801 ◽

pp. 34-42 ◽

Cited By ~ 8

Author(s):

Frans M. van der Kloet ◽

Margriet Hendriks ◽

Thomas Hankemeier ◽

Theo Reijmers

Keyword(s):

Mass Spectrometry ◽

Liquid Chromatography ◽

High Resolution ◽

Mass Spectrometry Data ◽

New Approach ◽

ISFrag: De Novo Recognition of In-Source Fragments for Liquid Chromatography–Mass Spectrometry Data

Analytical Chemistry ◽

10.1021/acs.analchem.1c01644 ◽

2021 ◽

Author(s):

Jian Guo ◽

Sam Shen ◽

Shipei Xing ◽

Huaxu Yu ◽

Tao Huan

Keyword(s):

Mass Spectrometry ◽

Liquid Chromatography ◽

De Novo ◽

Mass Spectrometry Data ◽

MSTracer: A Machine Learning Software Tool for Peptide Feature Detection from Liquid Chromatography–Mass Spectrometry Data

Journal of Proteome Research ◽

10.1021/acs.jproteome.0c01029 ◽

2021 ◽

Author(s):

Xiangyuan Zeng ◽

Bin Ma

Keyword(s):

Machine Learning ◽

Mass Spectrometry ◽

Liquid Chromatography ◽

Feature Detection ◽

Software Tool ◽

Mass Spectrometry Data ◽

Learning Software