Publicaciones en las que colabora con ELENA FORMOSO ESTENSORO (21)

2023

  1. One- and Two-Electron Reductions in MiniSOG and their Implication in Catalysis**

    ChemPhysChem, Vol. 24, Núm. 15

2021

  1. Enhancing the Photocatalytic Conversion of Pt(IV) Substrates by Flavoprotein Engineering

    Journal of Physical Chemistry Letters, Vol. 12, Núm. 19, pp. 4504-4508

2020

  1. Lignin solvation by ionic liquids: The role of cation

    Journal of Molecular Liquids, Vol. 303

  2. Theoretical characterization of Al(III) binding to KSPVPKSPVEEKG: Insights into the propensity of aluminum to interact with key sequences for neurofilament formation

    Journal of Inorganic Biochemistry, Vol. 210

2019

  1. Does phosphorylation increase the binding affinity of aluminum? A computational study on the aluminum interaction with serine and O-phosphoserine

    Journal of Inorganic Biochemistry, Vol. 192, pp. 33-44

  2. One pot stimuli-responsive linear waterborne polyurethanes via Diels-Alder reaction

    Progress in Organic Coatings, Vol. 130, pp. 31-43

  3. Tetravalent Oxygen and Sulphur Centres Mediated by Carborane Superacid: Theoretical Analysis

    ChemPhysChem, Vol. 20, Núm. 19, pp. 2443-2450

2018

  1. Aluminum's preferential binding site in proteins: sidechain of amino acids versus backbone interactions

    Journal of Inorganic Biochemistry, Vol. 181, pp. 111-116

  2. Tuning the affinity of catechols and salicylic acids towards Al(III): Characterization of Al-chelator interactions

    Dalton Transactions, Vol. 47, Núm. 29, pp. 9592-9607

2017

  1. A computational study on interaction of aluminum with d-glucose 6-phosphate for various stoichiometries

    RSC Advances, Vol. 7, Núm. 10, pp. 6064-6079

  2. The role of non-covalent interactions in the self-healing mechanism of disulfide-based polymers

    Physical Chemistry Chemical Physics, Vol. 19, Núm. 28, pp. 18461-18470

2016

  1. Phosphorylation promotes Al(iii) binding to proteins: GEGEGSGG as a case study

    Physical Chemistry Chemical Physics, Vol. 18, Núm. 10, pp. 7197-7207

  2. Structural and optical properties of the naked and passivated Al5Au5 bimetallic nanoclusters

    Journal of Chemical Physics, Vol. 144, Núm. 11

2015

  1. Aluminum and its effect in the equilibrium between folded/unfolded conformation of NADH

    Journal of Inorganic Biochemistry, Vol. 152, pp. 139-146

  2. Aluminum interaction with 2,3-diphosphoglyceric acid. A computational study

    RSC Advances, Vol. 5, Núm. 78, pp. 63874-63881

2010

  1. Molecular dynamics simulation of bovine pancreatic ribonuclease A-CpA and transition state-like complexes

    Journal of Physical Chemistry B, Vol. 114, Núm. 21, pp. 7371-7382

2008

  1. Magnetic endohedral transition-metal-doped semiconduncting-nanoclusters

    Chemistry - A European Journal, Vol. 14, Núm. 28, pp. 8547-8554

2007

  1. Endohedral (X@ZniSi)i-4-16 .0,± nanoclusters, X = Li, Na, K, Cl, Br

    Journal of Physical Chemistry C, Vol. 111, Núm. 9, pp. 3560-3565

  2. Endohedral stannaspherenes Mn@Sn12 and its dimer: Ferromagnetic or antiferromagnetic?

    ChemPhysChem, Vol. 8, Núm. 14, pp. 2096-2099

2006

  1. Reaction mechanism of the acidic hydrolysis of highly twisted amides: Rate acceleration caused by the twist of the amide bond

    Journal of Physical Chemistry B, Vol. 110, Núm. 30, pp. 15000-15011