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Integration of machine learning in 3D-QSAR CoMSIA models for the identification of lipid antioxidant peptides
The comparative molecular similarity indices analysis (CoMSIA) method is a widely used 3D-quantitative structure–activity relationship (QSAR) approach in the field of medicinal chemistry and drug design. However, relying solely on the Partial Least Square algorithm to build models using numerous CoM...
Autores principales: | , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
The Royal Society of Chemistry
2023
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Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10654693/ https://www.ncbi.nlm.nih.gov/pubmed/38020021 http://dx.doi.org/10.1039/d3ra06690h |