Mostrando 10 resultados de: 10
Filtros aplicados
Subtipo de publicación
Article(10)
Publisher
Journal of Theoretical Biology(3)
Scientific Reports(2)
Antibiotics(1)
Frontiers in Chemistry(1)
Journal of Chemical Information and Modeling(1)
Área de conocimiento
Proteína(4)
Bioquímica(3)
Ciencias de la computación(3)
Relación cuantitativa estructura-actividad(2)
Descubrimiento de fármacos(1)
Origen
google(1)
Complex Networks Analyses of Antibiofilm Peptides: An Emerging Tool for Next-Generation Antimicrobials’ Discovery
ArticleAbstract: Microbial biofilms cause several environmental and industrial issues, even affecting human health. APalabras claves:antibiofilm peptide, centrality measure, chemical space, Complex network, motif discovery, StarPep toolboxAutores:Agüero-Chapin G., Antunes A., César H. Zambrano, Ernesto Contreras-Torres, Jose R. Mora, Martinez-Rios F.O., Noel Perez, Valdés-Martiní J.R., Yovani Marrero-PonceFuentes:scopusFuzzy spherical truncation-based multi-linear protein descriptors: From their definition to application in structural-related pbkp_redictions
ArticleAbstract: This study introduces a set of fuzzy spherically truncated three-dimensional (3D) multi-linear descrPalabras claves:3D-protein descriptors, folding rate, fuzzy membership degree, fuzzy membership functions, MuLiMs-MCoMPAs, multi-linear algebraic forms, SCOP structural classes tensor algebra-based fuzzy spherically truncated descriptors for protein Science, spherical truncationAutores:Agüero-Chapin G., Antunes A., César R. García-Jacas, Ernesto Contreras-Torres, Julio E. Terán, Yovani Marrero-PonceFuentes:scopusExamining the pbkp_redictive accuracy of the novel 3D N-linear algebraic molecular codifications on benchmark datasets
ArticleAbstract: Background: Recently, novel 3D alignment-free molecular descriptors (also known as QuBiLS-MIDAS) basPalabras claves:3D-QSAR, multiple linear regression, QuBiLS-MIDAS, ToMoCoMD-CARDDAutores:César R. García-Jacas, Ernesto Contreras-Torres, Lisset Cabrera-Leyva, Pupo-Meriño M., Stephen Jones Barigye, Yovani Marrero-PonceFuentes:scopusMuLiMs-MCoMPAs: A Novel Multiplatform Framework to Compute Tensor Algebra-Based Three-Dimensional Protein Descriptors
ArticleAbstract: This report introduces the MuLiMs-MCoMPAs software (acronym for Multi-Linear Maps based on N-MetricPalabras claves:Autores:Brizuela C.A., César R. García-Jacas, Ernesto Contreras-Torres, Julio E. Terán, Sánchez-Rodríguez J.C., Yovani Marrero-PonceFuentes:scopusNovel 3D bio-macromolecular bilinear descriptors for protein science: Pbkp_redicting protein structural classes
ArticleAbstract: In the present study, we introduce novel 3D protein descriptors based on the bilinear algebraic formPalabras claves:3D protein descriptor, Bilinear form, Coulombic matrix, Lda, Protein structural classesAutores:Alvarado Y.J., César R. García-Jacas, Cubillan N., Ernesto Contreras-Torres, Stephen Jones Barigye, Yovani Marrero-PonceFuentes:scopusLEGO-based generalized set of two linear algebraic 3D bio-macro-molecular descriptors: Theory and validation by QSARs
ArticleAbstract: Novel 3D protein descriptors based on bilinear, quadratic and linear algebraic maps in Rn are proposPalabras claves:3D-protein descriptor, aggregation operator, Amino acid interaction, folding rate, Machine learning, METRICS, Normalization procedure, Protein structural classes, Two-linear algebraic formsAutores:César R. García-Jacas, Cubillan N., Ernesto Contreras-Torres, Julio E. Terán, Pérez-Giménez F., Valdés-Martiní J.R., Yovani Marrero-Ponce, Yunierkis Perez-CastilloFuentes:scopusSearching glycolate oxidase inhibitors based on QSAR, molecular docking, and molecular dynamic simulation approaches
ArticleAbstract: Primary hyperoxaluria type 1 (PHT1) treatment is mainly focused on inhibiting the enzyme glycolate oPalabras claves:Autores:Ernesto Contreras-Torres, José Luis Paz, Jose R. Mora, Marquez E.A., Nicolás Cabrera, Noel Perez, Patricio Javier Espinoza-Montero, Sebastian Cuesta, Yovani Marrero-PonceFuentes:googlescopusQuBiLS-MIDAS: A parallel free-software for molecular descriptors computation based on multilinear algebraic maps
ArticleAbstract: The present report introduces the QuBiLS-MIDAS software belonging to the ToMoCoMD-CARDD suite for thPalabras claves:3D N-linear indices, chemical development kit, double stochastic and mutual probability matrices, Java language, N-tuple simple stochastic, N-tuple spatial-(Dis)similarity matrix, QuBiLS-MIDAS, scalability, Speed up, ToMoCoMD-CARDDAutores:Acevedo-Martínez L., César R. García-Jacas, Ernesto Contreras-Torres, Stephen Jones Barigye, Valdés-Martiní J.R., Yovani Marrero-PonceFuentes:scopusPbkp_redicting structural classes of proteins by incorporating their global and local physicochemical and conformational properties into general Chou's PseAAC
ArticleAbstract: In this study, I introduce novel global and local 0D-protein descriptors based on a statistical quanPalabras claves:0D-protein descriptor, Amino acid-group, Amino acid-type, Nearest Neighbor, Protein structural classes, Total sum of squaresAutores:Ernesto Contreras-TorresFuentes:scopusTensor Algebra-based Geometrical (3D) Biomacro-Molecular Descriptors for Protein Research: Theory, Applications and Comparison with other Methods
ArticleAbstract: In this report, a new type of tridimensional (3D) biomacro-molecular descriptors for proteins are prPalabras claves:Autores:César R. García-Jacas, Enrique Terán, Ernesto Contreras-Torres, Fernando Javier Torres, Julio E. Terán, Vivas-Reyes R., Yovani Marrero-PonceFuentes:scopus