Publicaciones en colaboración con investigadores/as de Donostia International Physics Center (8)

2022

  1. Unravelling the binding affinity and selectivity of molybdenum(ii) phenanthroline complexes with DNA G-quadruplexes by using linear-scaling DFT studies. The important role of ancillary ligands

    Physical Chemistry Chemical Physics, Vol. 24, Núm. 42, pp. 25918-25929

2021

  1. Mechanistic Insights into Promoted Hydrolysis of Phosphoester Bonds by MoO2Cl2(DMF)2

    Inorganic Chemistry, Vol. 60, Núm. 15, pp. 11177-11191

  2. New insights on the interaction of phenanthroline based ligands and metal complexes and polyoxometalates with duplex dna and g-quadruplexes

    Molecules, Vol. 26, Núm. 16

  3. Probing the Catalytically Active Species in POM-Catalysed DNA-Model Hydrolysis**

    Chemistry - A European Journal, Vol. 27, Núm. 35, pp. 8977-8984

2020

  1. Computational Studies on the Binding Preferences of Molybdenum(II) Phenanthroline Complexes with Duplex DNA. The Important Role of the Ancillary Ligands

    Inorganic Chemistry, Vol. 59, Núm. 17, pp. 12711-12721

2018

  1. Theoretical study of the adsorption of hydrogen on cobalt clusters

    Physical Chemistry Chemical Physics, Vol. 20, Núm. 32, pp. 21163-21176

2009

  1. Phonon surface mapping of graphite: Disentangling quasi-degenerate phonon dispersions

    Physical Review B - Condensed Matter and Materials Physics, Vol. 80, Núm. 8

2007

  1. Vibrational properties of hexagonal boron nitride: Inelastic X-ray scattering and Ab Initio calculations

    Physical Review Letters, Vol. 98, Núm. 9