3D-QSARpy: Combining variable selection strategies and machine learning techniques to build QSAR models

3D-QSARpy: Combining variable selection strategies and machine learning techniques to build QSAR models

Abstract Quantitative Structure-Activity Relationship (QSAR) is a computer-aided technology in the field of medicinal chemistry that seeks to clarify the relationships between molecular structures and their biological activities. Such technologies allow for the acceleration of the development of new...

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Bibliographic Details
Main Authors:	Priscilla Suene de Santana Nogueira Silverio, Jéssika de Oliveira Viana, Euzébio Guimarães Barbosa
Format:	Article
Language:	English
Published:	Universidade de São Paulo 2023-05-01
Series:	Brazilian Journal of Pharmaceutical Sciences
Subjects:	Drug Design 3D-QSAR Machine learning Variable selection
Online Access:	http://www.scielo.br/scielo.php?script=sci_arttext&pid=S1984-82502023000100358&lng=en&tlng=en

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