Publicaciones en colaboración con investigadoras/es de Donostia International Physics Center (45)

2024

  1. Red-Light Photocatalytic Activation Of Pt(IV) Anticancer Prodrugs Using Methylene Blue

    ChemRxiv

2023

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

    ChemPhysChem, Vol. 24, Núm. 15

  2. Time-optimal control of driven oscillators by variational circuit learning

    Physical Review Research, Vol. 5, Núm. 2

  3. Toward Prediction of Financial Crashes with a D-Wave Quantum Annealer

    Entropy, Vol. 25, Núm. 2

2022

  1. Digitized-counterdiabatic quantum approximate optimization algorithm

    Physical Review Research, Vol. 4, Núm. 1

  2. Halogen-free photosensitizers based on meso-enamine-BODIPYs for bioimaging and photodynamic therapy

    Journal of Materials Chemistry B, Vol. 11, Núm. 1, pp. 169-179

  3. Spectro-temporal behavior of dye-based solid-state random lasers under picosecond pumping regime

    Optics Express, Vol. 30, Núm. 6, pp. 9674-9684

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

  2. Mild Open-Shell Character of BODIPY and Its Impact on Singlet and Triplet Excitation Energies

    Journal of Chemical Theory and Computation, Vol. 17, Núm. 9, pp. 5825-5838

  3. Molecular dynamics and experimental study on the adhesion mechanism of polyvinyl alcohol (PVA) fiber in alkali-activated slag/fly ash

    Cement and Concrete Research, Vol. 145

  4. Toward pricing financial derivatives with an IBM quantum computer

    Physical Review Research, Vol. 3, Núm. 1

2020

  1. Flavin bioorthogonal photocatalysis toward platinum substrates

    ACS Catalysis, Vol. 10, Núm. 1, pp. 187-196

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

    Journal of Molecular Liquids, Vol. 303

  3. THz fingerprints of cement-based materials

    Materials, Vol. 13, Núm. 18

  4. 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. Effect of Regioisomerism on Processability and Mechanical Properties of Amine/Urea Exchange Based Poly(urea-urethane) Vitrimers

    ACS Applied Polymer Materials, Vol. 1, Núm. 9, pp. 2472-2481

  3. Improvement of the electrochemical and singlet fission properties of anthraquinones by modification of the diradical character

    Physical Chemistry Chemical Physics, Vol. 21, Núm. 15, pp. 7941-7952

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

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

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

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