Publicaciones en las que colabora con Elena Formoso Estensoro (14)
2023
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One- and Two-Electron Reductions in MiniSOG and their Implication in Catalysis**
ChemPhysChem, Vol. 24, Núm. 15
2021
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Enhancing the Photocatalytic Conversion of Pt(IV) Substrates by Flavoprotein Engineering
Journal of Physical Chemistry Letters, Vol. 12, Núm. 19, pp. 4504-4508
2020
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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
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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
2018
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Aluminum's preferential binding site in proteins: sidechain of amino acids versus backbone interactions
Journal of Inorganic Biochemistry, Vol. 181, pp. 111-116
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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
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A computational study on interaction of aluminum with d-glucose 6-phosphate for various stoichiometries
RSC Advances, Vol. 7, Núm. 10, pp. 6064-6079
2016
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Phosphorylation promotes Al(iii) binding to proteins: GEGEGSGG as a case study
Physical Chemistry Chemical Physics, Vol. 18, Núm. 10, pp. 7197-7207
2015
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Aluminum and its effect in the equilibrium between folded/unfolded conformation of NADH
Journal of Inorganic Biochemistry, Vol. 152, pp. 139-146
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Aluminum interaction with 2,3-diphosphoglyceric acid. A computational study
RSC Advances, Vol. 5, Núm. 78, pp. 63874-63881
2010
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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
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Magnetic endohedral transition-metal-doped semiconduncting-nanoclusters
Chemistry - A European Journal, Vol. 14, Núm. 28, pp. 8547-8554
2007
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Endohedral stannaspherenes Mn@Sn12 and its dimer: Ferromagnetic or antiferromagnetic?
ChemPhysChem, Vol. 8, Núm. 14, pp. 2096-2099
2006
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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