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Journal ArticleDOI

PLS-regression: a basic tool of chemometrics

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TLDR
PLS-regression (PLSR) as mentioned in this paper is the PLS approach in its simplest, and in chemistry and technology, most used form (two-block predictive PLS) is a method for relating two data matrices, X and Y, by a linear multivariate model.
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This article is published in Chemometrics and Intelligent Laboratory Systems.The article was published on 2001-10-28. It has received 7861 citations till now. The article focuses on the topics: Partial least squares regression.

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Journal ArticleDOI

Paradigm Shift in Toxicity Testing and Modeling

TL;DR: It is perceivable that new in silico toxicity models based on high-quality qHTS data will achieve unprecedented reliability and robustness, thus becoming a valuable tool for risk assessment and drug discovery.
Journal ArticleDOI

Sympathoadrenal Activation is Associated with Acute Traumatic Coagulopathy and Endotheliopathy in Isolated Brain Injury.

TL;DR: Biomarker profiles in patients with an unfavorable outcome displayed procoagulation, hyperfibrinolysis, glycocalyx and endothelial damage, vasculature activation, and inflammation, suggesting biomarkers of coagulopathy and endotheliopathy are associated with poor outcome after TBI.
Journal ArticleDOI

Determination of tetracycline hydrochloride by terahertz spectroscopy with PLSR model.

TL;DR: Overall, THz spectroscopy combined with PLSR model had its potential for the rapid and non-destructive prediction of TC-HCl residue without sophisticated methods, although the accuracy was not high for solution samples which should be improved in future study.
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Real-Time NDT-NDE Through an Innovative Adaptive Partial Least Squares SVR Inversion Approach

TL;DR: A feature extraction technique based on partial least squares is profitably combined with a customized output space filling (OSF) adaptive sampling scheme for generating optimal training databases, while accurate and robust reconstructions are performed with a support vector regression (SVR) algorithm.
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Modeling soil parameters using hyperspectral image reflectance in subtropical coastal wetlands

TL;DR: Optimism is provided that remote-sensing spectral models can successfully predict soil properties indicative of ecosystem nutrient and organic matter turnover and storage, and do so in areas with dense canopy cover.
References
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Book

Regression Diagnostics: Identifying Influential Data and Sources of Collinearity

TL;DR: In this article, the authors present a method for detecting and assessing Collinearity of observations and outliers in the context of extensions to the Wikipedia corpus, based on the concept of Influential Observations.
Book

A User's Guide to Principal Components

TL;DR: In this paper, the authors present a directory of Symbols and Definitions for PCA, as well as some classic examples of PCA applications, such as: linear models, regression PCA of predictor variables, and analysis of variance PCA for Response Variables.
Journal ArticleDOI

A Leisurely Look at the Bootstrap, the Jackknife, and Cross-Validation

TL;DR: This paper reviewed the nonparametric estimation of statistical error, mainly the bias and standard error of an estimator, or the error rate of a prediction rule, at a relaxed mathematical level, omitting most proofs, regularity conditions and technical details.
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