Documentos de Cubillan N. | REDI

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Filtros aplicados

Año de Publicación: "2015"

Subtipo de publicación

Publisher

Current Bioinformatics(1)

Journal of Chemical Thermodynamics(1)

Journal of Mathematical Chemistry(1)

Journal of Theoretical Biology(1)

Área temáticas

Química física(2)

Ciencias de la computación(1)

Fisiología humana(1)

Área de conocimiento

Ciencia de materiales(1)

Química física(1)

Química teórica(1)

Relación cuantitativa estructura-actividad(1)

Origen

Palabras Claves

ToMoCoMD-CARDD(2)

Variability analysis(2)

3D protein descriptor(1)

3D-linear index(1)

Novel 3D bio-macromolecular bilinear descriptors for protein science: Pbkp_redicting protein structural classes

Abstract: In the present study, we introduce novel 3D protein descriptors based on the bilinear algebraic form

Palabras claves:

3D protein descriptor, Bilinear form, Coulombic matrix, Lda, Protein structural classes

Alvarado Y.J., César R. García-Jacas, Cubillan N., Ernesto Contreras-Torres, Stephen Jones Barigye, Yovani Marrero-Ponce

Novel global and local 3D atom-based linear descriptors of the Minkowski distance matrix: theory, diversity–variability analysis and QSPR applications

Abstract: A new family of alignment-free 3D descriptors based on TOMOCOMD-CARDD framework has been designed, n

Palabras claves:

3D-linear index, QSPR study, ToMoCoMD-CARDD, Variability analysis

Alvarado Y.J., Ariza-Rico H., César R. García-Jacas, Cubillan N., Stephen Jones Barigye, Valdés-Martiní J.R., Yovani Marrero-Ponce

Optimum search strategies or novel 3D molecular descriptors: Is there a stalemate?

Abstract: The present manuscript describes a novel 3D-QSAR alignment free method (QuBiLS-MIDAS Duplex) based o

Palabras claves:

3D-QSAR, aggregation operator, Alignment free method, Minkowski distance matrix, Principal Component Analysis, QuBiLS-MIDAS, ToMoCoMD-CARDD, Two-tuple spatial-(dis)similarity matrix, Variability analysis

Alvarado Y.J., César R. García-Jacas, Cubillan N., Pino-Urias R.W., Rivera-Borroto O.M., Stephen Jones Barigye, Thu H.L.T., Valdés-Martiní J.R., Yovani Marrero-Ponce

Volume-related properties of thiophene and furan-2-carboxaldehyde phenylhydrazone derivatives in DMSO: A discussion about non-intrinsic contribution

Abstract: An analysis of the experimental and theoretical non-intrinsic contribution to the limiting partial m

Palabras claves:

Densitometry, Limiting partial molar volume, Non-intrinsic contribution, Refractometry, Scaled-particle theory, Specific and non-specific interactions

Alvarado Y.J., Ballestas-Barrientos A., Cubillan N., Ferrebuz A., Ferrer-Amado G., Infante M., Joan Vera-Villalobos, Restrepo J., Rodríguez-Lugo P.