The importance of choosing a proper validation strategy in predictive models. A tutorial with real examples

Author:

Lopez Eneko,Etxebarria-Elezgarai Jaione,Amigo Jose ManuelORCID,Seifert Andreas

Funder

España Ministerio de Ciencia e Innovación

Government of the Basque Country

Publisher

Elsevier BV

Subject

Spectroscopy,Environmental Chemistry,Biochemistry,Analytical Chemistry

Reference35 articles.

1. Data mining, machine learning, deep learning, chemometrics definitions, common points and trends (spoiler alert: VALIDATE your models!);Amigo;Brazilian J. Anal. Chem.,2021

2. Classification tools in chemistry. Part 1: linear models. PLS-DA;Ballabio;Anal. Methods,2013

3. So you think you can PLS-DA?;Ruiz-Perez;BMC Bioinf.,2020

4. Diagnosis of dementias using partial least squares discriminant analysis;J;Dementia,1995

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