Repositorio Institucional de la Universidad de Oviedo

Mostrando ítems 1-11 de 11

Avances metodológicos en el cálculo de la entropía conformacional y la energía de biomoléculas y su aplicación a modelos de colágeno

Suárez Álvarez, Ernesto (2011-11-28)
CENCALC : a computational tool for conformational entropy calculations from molecular simulations

Suárez Álvarez, Ernesto; Díaz Fernández, Natalia; Méndez Hurtado, Jefferson; Suárez Rodríguez, Dimas (2013)
Demineralization of whey and milk ultrafiltration permeate by means of nanofiltration

Suárez Álvarez, Ernesto; Lobo Rodríguez, Alberto; Álvarez Blanco, Silvia; Riera Rodríguez, Francisco Amador; Álvarez Fernández, Ricardo (2009)
Distinguishability in Entropy Calculations: Chemical Reactions, Conformational and Residual Entropy

Suárez Álvarez, Ernesto (2011)
Entropic Control of the Relative Stability of Triple-helical Collagen Peptide Models

Suárez Álvarez, Ernesto; Díaz Fernández, Natalia; Suárez Rodríguez, Dimas (2008)
Entropy Calculations of Single Molecules by Combining the Rigid-Rotor and Harmonic-Oscillator Approximations with Conformational Entropy Estimations from Molecular Dynamics Simulations

Suárez Álvarez, Ernesto; Díaz Fernández, Natalia; Suárez Rodríguez, Dimas (2011)
Kinetic and binding effects in peptide substrate selectivity of matrix metalloproteinase-2: Molecular dynamics and QM/MM calculations

Díaz Fernández, Natalia; Suárez Rodríguez, Dimas; Suárez Álvarez, Ernesto (2010)
Molecular dynamics and NMR analysis of the configurational13C assignment of epimeric 22,23-epoxides of stigmasterol

Suardíaz, Reynier; Maestre, Mitcheell; Suárez Álvarez, Ernesto; Bernardo, Yamilet; Alonso-Becerra, Esther; Pérez, Carlos (2008)
Molecular dynamics and quantum mechanical calculations on the mononuclear zinc-ß-lactamase from Bacillus cereus: Protonation state of the active site and imipenem binding

Suárez Rodríguez, Dimas; Suárez Álvarez, Ernesto; Díaz Fernández, Natalia (2009)
Multibody local approximation: Application to conformational entropy calculations on biomolecules

Suárez Álvarez, Ernesto; Suárez Rodríguez, Dimas (2012)
Thermochemical fragment energy method for biomolecules: Application to a collagen model peptide

Suárez Álvarez, Ernesto; Díaz Fernández, Natalia; Suárez Rodríguez, Dimas (2009)