Publicacións en colaboración con investigadores/as de Universidad Autónoma de Madrid (32)

2023

  1. Automatic characterization of drug/amino acid interactions by energy decomposition analysis

    Theoretical Chemistry Accounts, Vol. 142, Núm. 6

  2. Chiral Porous Organic Frameworks: Synthesis, Chiroptical Properties, and Asymmetric Organocatalytic Applications

    Catalysts, Vol. 13, Núm. 7

  3. Effect of the QM Size, Basis Set, and Polarization on QM/MM Interaction Energy Decomposition Analysis

    Journal of Chemical Information and Modeling, Vol. 63, Núm. 3, pp. 882-897

  4. Kidins220 sets the threshold for survival of neural stem cells and progenitors to sustain adult neurogenesis

    Cell death & disease, Vol. 14, Núm. 8, pp. 500

  5. Metastable Charged Dimers in Organometallic Species: A Look into Hydrogen Bonding between Metallocene Derivatives

    Inorganic chemistry, Vol. 62, Núm. 40, pp. 16523-16537

  6. MoBioTools: A toolkit to setup quantum mechanics/molecular mechanics calculations

    Journal of Computational Chemistry, Vol. 44, Núm. 4, pp. 516-533

  7. On the Permeation of Polychlorinated Dibenzodioxins and Dibenzofurans through Lipid Membranes: Classical MD and Hybrid QM/MM-EDA Analysis

    Membranes, Vol. 13, Núm. 1

2022

  1. Challenges for optical nanothermometry in biological environments

    Chemical Society reviews, Vol. 51, Núm. 11, pp. 4223-4242

  2. DNA-Templated Ultracompact Optical Antennas for Unidirectional Single-Molecule Emission

    Nano letters, Vol. 22, Núm. 15, pp. 6402-6408

2021

  1. Characterization of cisplatin/membrane interactions by QM/MM energy decomposition analysis

    Physical Chemistry Chemical Physics, Vol. 23, Núm. 36, pp. 20533-20540

  2. Deciphering the Chemical Basis of Fluorescence of a Selenium-Labeled Uracil Probe when Bound at the Bacterial Ribosomal A-Site

    Chemistry - A European Journal, Vol. 27, Núm. 15, pp. 4927-4931

2019

  1. Crystal structures of N6-modified-amino acid related nucleobase analogs (II): Hybrid adenine-β-alanine and adenine-GABA molecules

    New Journal of Chemistry, Vol. 43, Núm. 24, pp. 9680-9688

  2. Heat generation by branched Au/Pd nanocrystals: Influence of morphology and composition

    Nanoscale, Vol. 11, Núm. 41, pp. 19561-19570

  3. Thermal monitoring during photothermia: Hybrid probes for simultaneous plasmonic heating and near-infrared optical nanothermometry

    Theranostics, Vol. 9, Núm. 24, pp. 7298-7312

2016

  1. Friedel-Crafts Alkylation of Indoles with p-Quinols: The Role of Hydrogen Bonding of Water for the Desymmetrization of the Cyclohexadienone System

    Organic Letters, Vol. 18, Núm. 9, pp. 2224-2227

2015

  1. Microgels and nanoparticles: Where Micro and Nano Go Hand in Hand

    Zeitschrift fur Physikalische Chemie, Vol. 229, Núm. 1-2, pp. 263-282

2014

  1. Experimental data, correlation and prediction of the extraction of benzene from cyclic hydrocarbons using [Epy][ESO4] ionic liquid

    Fluid Phase Equilibria, Vol. 361, pp. 83-92

  2. Laser heating tunability by off-resonant irradiation of gold nanoparticles

    Small, Vol. 10, Núm. 2, pp. 376-384

  3. Quantum dot thermometry evaluation of geometry dependent heating efficiency in gold nanoparticles

    Langmuir, Vol. 30, Núm. 6, pp. 1650-1658

  4. Simple diazonium chemistry to develop specific gene sensing platforms

    Analytica Chimica Acta, Vol. 813, pp. 41-47