Publicaciones en colaboración con investigadores/as de Universidade de Santiago de Compostela (42)

2024

  1. A Hierarchical Polyoxometalate/Pd/Mos2 Hybrid: Developing an Efficient Novel Bifunctional Catalyst for Water Splitting

    Advanced Sustainable Systems, Vol. 8, Núm. 5

2023

  1. Free energy along drug-protein binding pathways interactively sampled in virtual reality

    Scientific Reports, Vol. 13, Núm. 1

2022

  1. Heterometallic palladium-iron metal-organic framework as a highly active catalyst for cross-coupling reactions

    Chemical Science, Vol. 14, Núm. 1, pp. 179-185

2021

  1. Rational Design of Copper(II)-Uracil Nanoprocessed Coordination Polymers to Improve Their Cytotoxic Activity in Biological Media

    ACS Applied Materials and Interfaces, Vol. 13, Núm. 31, pp. 36948-36957

2020

  1. Characterization of Locally Excited and Charge-Transfer States of the Anticancer Drug Lapatinib by Ultrafast Spectroscopy and Computational Studies

    Chemistry - A European Journal, Vol. 26, Núm. 68, pp. 15922-15930

2019

  1. Hexanuclear Cu3O-3Cu triazole-based units as novel core motifs for high nuclearity copper(ii) frameworks

    RSC Advances, Vol. 9, Núm. 50, pp. 29357-29367

2018

  1. Unravelling the spin-state of solvated [Fe(bpp) 2 ] 2+ spin-crossover complexes: structure-function relationship

    Dalton Transactions, Vol. 47, Núm. 31, pp. 10453-10462

  2. Discrete Cu(i) complexes for azide-alkyne annulations of small molecules inside mammalian cells

    Chemical Science, Vol. 9, Núm. 7, pp. 1947-1952

  3. Metal complexes of a novel heterocyclic benzimidazole ligand formed by rearrangement-cyclization of the corresponding Schiff base. Electrosynthesis, structural characterization and antimicrobial activity

    Dalton Transactions, Vol. 47, Núm. 12, pp. 4325-4340

2015

  1. TBuLi-Mediated One-Pot Direct Highly Selective Cross-Coupling of Two Distinct Aryl Bromides

    Chemistry - A European Journal, Vol. 21, Núm. 44, pp. 15520-15524

2014

  1. The Dalton quantum chemistry program system

    Wiley Interdisciplinary Reviews: Computational Molecular Science, Vol. 4, Núm. 3, pp. 269-284

  2. Two novel ternary dicopper(II) μ-guanazole complexes with aromatic amines strongly activated by quantum dots for DNA cleavage

    Inorganic Chemistry, Vol. 53, Núm. 1, pp. 578-593

2013

  1. Novel hexanuclear copper(II) complex built from a simple tetrachelating triazole ligand: Synthesis, structure, and magnetism

    Inorganic Chemistry, Vol. 52, Núm. 5, pp. 2289-2291

  2. Two copper complexes from two novel naphthalene-sulfonyl-triazole ligands: Different nuclearity and different DNA binding and cleavage capabilities

    Journal of Inorganic Biochemistry, Vol. 125, pp. 50-63

2012

  1. A unique discrete tetranuclear Cu′-Cu(N-N)2Cu-Cu′ copper(II) complex, built from a μ3-1,2,4-triazolato-μ- carboxylato ligand, as an effective DNA cleavage agent

    Inorganic Chemistry, Vol. 51, Núm. 18, pp. 9809-9819

  2. Detoxifying Antitumoral Drugs via Nanoconjugation: The Case of Gold Nanoparticles and Cisplatin

    PLoS ONE, Vol. 7, Núm. 10

  3. SiPMs coated with TPB: Coating protocol and characterization for NEXT

    Journal of Instrumentation, Vol. 7, Núm. 2

2011

  1. The CCSD(T) model with Cholesky decomposition of orbital energy denominators

    International Journal of Quantum Chemistry, Vol. 111, Núm. 2, pp. 349-355

  2. Three-dimensional mixed-ligand coordination polymers with ferromagnetically coupled cyclic tetranuclear copper(II) units bonded by weak interactions

    Crystal Growth and Design, Vol. 11, Núm. 10, pp. 4344-4352

2010

  1. Estuarine sediment quality assessment by Fourier-transform infrared spectroscopy

    Vibrational Spectroscopy, Vol. 53, Núm. 2, pp. 204-213