Multivariate statistical methodologies applied in biomedical Raman spectroscopy: assessing the validity of partial least squares regression using simulated model datasets

Mark E. Keating; Haq Nawaz; Franck Bonnier; Hugh J. Byrne

doi:10.1039/c4an02167c

Multivariate statistical methodologies applied in biomedical Raman spectroscopy: assessing the validity of partial least squares regression using simulated model datasets

The Analyst ◽

10.1039/c4an02167c ◽

2015 ◽

Vol 140 (7) ◽

pp. 2482-2492 ◽

Cited By ~ 23

Author(s):

Mark E. Keating ◽

Haq Nawaz ◽

Franck Bonnier ◽

Hugh J. Byrne

Keyword(s):

Raman Spectroscopy ◽

Data Analysis ◽

Least Squares ◽

Partial Least Squares ◽

Biomedical Applications ◽

Partial Least Squares Regression ◽

Least Squares Regression ◽

Multivariate Statistical ◽

Simulated Model ◽

Analysis Tools

In the drive towards biomedical applications of Raman spectroscopy, it is critically important to validate the data analysis tools.

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Development of Nondestructive Detection Method for Adulterated Powder Products Using Raman Spectroscopy and Partial Least Squares Regression

Journal of the Korean Society for Nondestructive Testing ◽

10.7779/jksnt.2014.34.4.283 ◽

2014 ◽

Vol 34 (4) ◽

pp. 283-289 ◽

Cited By ~ 8

Author(s):

Sangdae Lee ◽

Santosh Lohumi ◽

Byoung-Kwan Cho ◽

Moon S. Kim ◽

Soo-Hee Lee

Keyword(s):

Raman Spectroscopy ◽

Least Squares ◽

Partial Least Squares ◽

Partial Least Squares Regression ◽

Detection Method ◽

Least Squares Regression ◽

Nondestructive Detection

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Sparse partial least-squares regression and its applications to high-throughput data analysis

Chemometrics and Intelligent Laboratory Systems ◽

10.1016/j.chemolab.2011.07.002 ◽

2011 ◽

Vol 109 (1) ◽

pp. 1-8 ◽

Cited By ~ 51

Author(s):

Donghwan Lee ◽

Woojoo Lee ◽

Youngjo Lee ◽

Yudi Pawitan

Keyword(s):

Data Analysis ◽

Least Squares ◽

Partial Least Squares ◽

High Throughput ◽

Partial Least Squares Regression ◽

Least Squares Regression ◽

High Throughput Data ◽

High Throughput Data Analysis

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Quantitative Analysis of Entacapone Isomers Using Surface-Enhanced Raman Spectroscopy and Partial Least Squares Regression

Applied Spectroscopy ◽

10.1366/12-06752 ◽

2012 ◽

Vol 66 (12) ◽

pp. 1468-1474 ◽

Cited By ~ 3

Author(s):

Marina Ratkaj ◽

Tomislav Biljan ◽

Snežana Miljanić

Keyword(s):

Raman Spectroscopy ◽

Quantitative Analysis ◽

Least Squares ◽

Partial Least Squares ◽

Partial Least Squares Regression ◽

Surface Enhanced Raman Spectroscopy ◽

Least Squares Regression ◽

Surface Enhanced ◽

Surface Enhanced Raman

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Data analysis of heavy metal pollution in the sea by using principal component analysis and partial least squares regression

Chemometrics and Intelligent Laboratory Systems ◽

10.1016/0169-7439(89)80120-0 ◽

1989 ◽

Vol 7 (1-2) ◽

pp. 163-170 ◽

Cited By ~ 11

Author(s):

Sulo Piepponen ◽

Reijo Lindström

Keyword(s):

Heavy Metal ◽

Principal Component Analysis ◽

Data Analysis ◽

Least Squares ◽

Partial Least Squares ◽

Metal Pollution ◽

Heavy Metal Pollution ◽

Partial Least Squares Regression ◽

Principal Component ◽

Least Squares Regression

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Sparse partial least-squares regression for high-throughput survival data analysis

Statistics in Medicine ◽

10.1002/sim.5975 ◽

2013 ◽

Vol 32 (30) ◽

pp. 5340-5352 ◽

Cited By ~ 5

Author(s):

Donghwan Lee ◽

Youngjo Lee ◽

Yudi Pawitan ◽

Woojoo Lee

Keyword(s):

Data Analysis ◽

Least Squares ◽

Partial Least Squares ◽

High Throughput ◽

Survival Data ◽

Partial Least Squares Regression ◽

Least Squares Regression

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Hyperspectral Data Analysis Algorithm Based on Partial Least-squares Regression Model and Its Application in the Identification of Hogwash Oil

Journal of Information and Computational Science ◽

10.12733/jics20106180 ◽

2015 ◽

Vol 12 (10) ◽

pp. 4087-4094 ◽

Cited By ~ 1

Author(s):

Dong Zhang

Keyword(s):

Data Analysis ◽

Regression Model ◽

Least Squares ◽

Partial Least Squares ◽

Partial Least Squares Regression ◽

Hyperspectral Data ◽

Least Squares Regression ◽

Analysis Algorithm

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Quantitative Analysis of Simulated Illicit Street-Drug Samples Using Raman Spectroscopy and Partial Least Squares Regression

Spectroscopy Letters ◽

10.1080/00387010.2010.525285 ◽

2011 ◽

Vol 44 (4) ◽

pp. 229-234 ◽

Cited By ~ 14

Author(s):

Owen S. Fenton ◽

Lindsey A. Tonge ◽

Taylor H. Moot ◽

Kimberley A. Frederick

Keyword(s):

Raman Spectroscopy ◽

Quantitative Analysis ◽

Least Squares ◽

Partial Least Squares ◽

Partial Least Squares Regression ◽

Least Squares Regression

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An improved partial least-squares regression method for Raman spectroscopy

Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy ◽

10.1016/j.saa.2017.05.038 ◽

2017 ◽

Vol 185 ◽

pp. 98-103 ◽

Cited By ~ 6

Author(s):

Ali Momenpour Tehran Monfared ◽

Hanan Anis

Keyword(s):

Raman Spectroscopy ◽

Least Squares ◽

Partial Least Squares ◽

Partial Least Squares Regression ◽

Regression Method ◽

Least Squares Regression

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The Jackknife Interval Estimation of Parametersin Partial Least Squares Regression Modelfor Poverty Data Analysis

IPTEK The Journal for Technology and Science ◽

10.12962/j20882033.v21i3.42 ◽

2010 ◽

Vol 21 (3) ◽

Cited By ~ 3

Author(s):

Pudji Ismartini ◽

Sony Sunaryo ◽

Setiawan Setiawan

Keyword(s):

Data Analysis ◽

Least Squares ◽

Partial Least Squares ◽

Partial Least Squares Regression ◽

Interval Estimation ◽

Least Squares Regression

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Use of Biplots and Partial Least Squares Regression in Microarray Data Analysis for Assessing Association between Genes Involved in Different Biological Pathways

Computational Intelligence Methods for Bioinformatics and Biostatistics - Lecture Notes in Computer Science ◽

10.1007/978-3-642-21946-7_10 ◽

2011 ◽

pp. 123-134 ◽

Cited By ~ 2

Author(s):

Niccoló Bassani ◽

Federico Ambrogi ◽

Danila Coradini ◽

Elia Biganzoli

Keyword(s):

Data Analysis ◽

Least Squares ◽

Partial Least Squares ◽

Microarray Data ◽

Partial Least Squares Regression ◽

Biological Pathways ◽

Microarray Data Analysis ◽

Least Squares Regression

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