Repositorio Institucional de la Universidad de Oviedo

Mostrando ítems 1-10 de 10

Ab Initio Benchmark Calculations on Ca(II) Complexes and Assessment of Density Functional Theory Methodologies

Suárez Rodríguez, Dimas; Rayón Rico, Víctor Manuel; Díaz Fernández, Natalia; Valdés González, Haydee (2011)
Asociaciones moleculares : análisis de la naturaleza de la interacción en complejos dímeros y trímeros de Van der Waals

Valdés González, Haydee (2003-11-20)
Experimental and theoretical investigation of the aromatic-aromatic interaction in isolated capped dipeptides

Gloaguen, Eric; Valdés González, Haydee; Pagliarulo, Francesca; Pollet, Rodolphe; Tardivel, Benjamin; Hobza, Pavel; Piuzzi, François; Mons, Michel (2010)
From the X-ray Compact Structure to the Elongated Form of the Full-Length MMP-2 Enzyme in Solution: A Molecular Dynamics Study

Díaz Fernández, Natalia; Suárez Álvarez, Dimas; Valdés González, Haydee (2008)
Interdomain Conformations in the Full-Length MMP-2 Enzyme Explored by Protein-Protein Docking Calculations Using pyDock

Valdés González, Haydee; Díaz Fernández, Natalia; Suárez Álvarez, Dimas; Fernández Recio, Juan (2010)
Ketone-alcohol hydrogen-transfer equilibria: Is the biooxidation of halohydrins blocked?

Bisogno Forconesi, Fabricio Román; García Urdiales, Eduardo; Valdés González, Haydee; Lavandera García, Iván; Kroutil, Wolfgang; Suárez Rodríguez, Dimas; Gotor Santamaría, Vicente Miguel (2010)
Monoligand Zn(II) complexes: Ab initio benchmark calculations and comparison with density functional theory methodologies

Rayón Rico, Víctor Manuel; Valdés González, Haydee; Díaz Fernández, Natalia; Suárez Rodríguez, Dimas (2008)
Phenylalanyl-glycyl-phenylalanine tripeptide: A model system for aromatic-aromatic side chain interactions in proteins

Valdés González, Haydee; Pluhackova, K.; Hobza, Pavel (2009)
Polyisocyanides of titanium

Rayón Rico, Víctor Manuel; Redondo Cristóbal, María del Pilar; Valdés González, Haydee; Barrientos Benito, María Carmen; Largo Cabrerizo, Antonio (2009)
Unraveling the Molecular Structure of the Catalytic Domain of Matrix Metalloproteinase-2 in Complex with a Triple-Helical Peptide by Means of Molecular Dynamics Simulations

Díaz Fernández, Natalia; Suárez Rodríguez, Dimas; Valdés González, Haydee (2013)