Examining the predictive accuracy of the novel 3D N-linear algebraic molecular codifications on benchmark datasets

BACKGROUND: Recently, novel 3D alignment-free molecular descriptors (also known as QuBiLS-MIDAS) based on two-linear, three-linear and four-linear algebraic forms have been introduced. These descriptors codify chemical information for relations between two, three and four atoms by using several (dis...

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Detalles Bibliográficos
Autores principales: García-Jacas, César R., Contreras-Torres, Ernesto, Marrero-Ponce, Yovani, Pupo-Meriño, Mario, Barigye, Stephen J., Cabrera-Leyva, Lisset
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Springer International Publishing 2016
Materias:
Research Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4768433/
https://www.ncbi.nlm.nih.gov/pubmed/26925168
http://dx.doi.org/10.1186/s13321-016-0122-x

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4768433/
https://www.ncbi.nlm.nih.gov/pubmed/26925168
http://dx.doi.org/10.1186/s13321-016-0122-x

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