Publicacións en colaboración con investigadores/as de Universidade Do Porto (76)

2024

  1. Ionogels based on protic ionic liquid - lithium salt mixtures

    Journal of Molecular Liquids, Vol. 397

  2. Size Matters: A Computational Study of Hydrogen Absorption in Ionic Liquids

    Journal of Chemical Information and Modeling, Vol. 64, Núm. 1, pp. 164-177

  3. Sustainable Silk-Based Particulate Systems for the Controlled Release of Pharmaceuticals and Bioactive Agents in Wound Healing and Skin Regeneration

    International Journal of Molecular Sciences, Vol. 25, Núm. 6

  4. Synergistic Effects of Functionalized WS2 and SiO2 Nanoparticles and a Phosphonium Ionic Liquid as Hybrid Additives of Low-Viscosity Lubricants

    Lubricants, Vol. 12, Núm. 2, pp. 58

  5. Tribological Improvement of Low-Viscosity Nanolubricants: MoO3, MoS2, WS2 and WC Nanoparticles as Additives

    Lubricants, Vol. 12, Núm. 3

2023

  1. Computational Modeling on Binding Interactions of Cyclodextrins with the Human Multidrug Resistance P-glycoprotein Toward Efficient Drug-delivery System Applications

    Current Topics in Medicinal Chemistry, Vol. 23, Núm. 1, pp. 62-75

  2. Deep ensembles vs committees for uncertainty estimation in neural-network force fields: Comparison and application to active learning

    Journal of Chemical Physics, Vol. 158, Núm. 20

  3. Effect of the addition of coated SiO2 nanoparticles on the tribological behavior of a low-viscosity polyalphaolefin base oil

    Wear, Vol. 530-531

  4. Experimental Investigation of Tribological and Rheological Behaviour of Hybrid Nanolubricants for Applications in Internal Combustion Engines

    Tribology Letters, Vol. 71, Núm. 1

  5. Interfacial structure of protic and aprotic ionic liquid-DMSO-Li salt mixtures near charged and neutral electrodes: A Molecular Dynamics study

    Journal of Molecular Liquids, Vol. 386

  6. Ionic liquid/metal salt mixtures at the graphene interface: A density functional theory approach

    Journal of Molecular Liquids, Vol. 392

  7. Mixtures of ethylammonium nitrate and ethylene carbonate: Bulk and interfacial analysis

    Journal of Molecular Liquids, Vol. 385

  8. Thermophysical properties of n-alkyl-ammonium nitrate ionic liquids (n = 2,3,4) pure and water saturated for energy applications

    Journal of Thermal Analysis and Calorimetry, Vol. 148, Núm. 14, pp. 6699-6714

  9. Tribological enhancement of potential electric vehicle lubricants using coated TiO2 nanoparticles as additives

    Journal of Molecular Liquids, Vol. 371

2022

  1. Ecotoxicity of binary mixtures of ILs and inorganic salts of electrochemical interest

    Environmental Science and Pollution Research, Vol. 29, Núm. 17, pp. 24983-24994

  2. Enthalpy of solvation of alkali metal salts in a protic ionic liquid: Effect of cation charge and size

    Journal of Molecular Liquids, Vol. 360

  3. Modeling and experimental validation of covalent immobilization of Trametes maxima laccase on glyoxyl and MANA-Sepharose CL 4B supports, for the use in bioconversion of residual colorants

    Biotechnology and Applied Biochemistry, Vol. 69, Núm. 2, pp. 479-491

  4. Molecular Dynamics Simulations of Transmembrane Cyclic Peptide Nanotubes Using Classical Force Fields, Hydrogen Mass Repartitioning, and Hydrogen Isotope Exchange Methods: A Critical Comparison

    International Journal of Molecular Sciences, Vol. 23, Núm. 6

  5. On the physical properties of mixtures of nitrate salts and protic ionic liquids

    Journal of Molecular Liquids, Vol. 350

  6. On the structure and stability of novel cationic DPPC liposomes doped with gemini surfactants

    Journal of Molecular Liquids, Vol. 366