Publications (16) OSCAR TOLEDANO SANZ publications

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2026

  1. An AI-based approach accelerates the discovery of protein–protein interaction modulators targeting NCS-1

    European Journal of Medicinal Chemistry, Vol. 309

  2. Broadband dielectric permittivity analysis and modelling of polypropylene/pyrograf® III carbon nanofiber composites prepared by melt-extrusion

    Materials Research Bulletin, Vol. 201

  3. MolOrgGPT: De Novo Generation via Large Language Models and Reinforcement Learning

    Journal of Chemical Information and Modeling, Vol. 66, Núm. 2, pp. 910-922

  4. Role of solvent polarity in controlling the formation of electroactive β/γ-phases in poly(vinylidene fluoride) nanoparticles

    Polymer, Vol. 345

2025

  1. Energetics and structural characterization of Poly(trifluoroethylene) from first principles calculations

    Polymer, Vol. 337

  2. On the Nature of Fluorescence Modification Induced by Deformation in Regenerated Silk Fibroin

    ACS Applied Bio Materials, Vol. 8, Núm. 10, pp. 9268-9276

  3. Theoretical approach to the crystal structure of poly(butylene 2,5-furandicarboxylate) as revealed by density functional theory

    Journal of Chemical Physics, Vol. 162, Núm. 12

2024

  1. Doping Effect of Poly(vinylidene fluoride) on Carbon Nanofibers Deduced by Thermoelectric Analysis of Their Melt Mixed Films

    Chinese Journal of Polymer Science (English Edition), Vol. 42, Núm. 11, pp. 1802-1810

  2. Study of the Crystal Structure and Hydrogen Bonding during Cold Crystallization of Poly(trimethylene 2,5-furandicarboxylate)

    Macromolecules, Vol. 57, Núm. 5, pp. 2218-2229

2023

  1. Ab initio characterization of the polyvinylidene difluoride phases and their interaction with Carbon Nanotubes

    1st Iberian Symposium on Functional Organic Polymers

  2. Evidence for three-dimensional Dirac conical bands in TlBiSSe by optical and magneto-optical spectroscopy

    Physical Review B, Vol. 107, Núm. 24

  3. Inter and intra molecular dynamics in poly(trimethylene 2,5-furanoate) as revealed by infrared and Broadband Dielectric Spectroscopies

    Polymer, Vol. 268

2021

  1. Effects of confinement and vaccination on an epidemic outburst: A statistical mechanics approach

    Physical Review E, Vol. 104, Núm. 3

  2. Melting in two-dimensional systems: Characterizing continuous and first-order transitions

    Physical Review B, Vol. 103, Núm. 9

2020

  1. Energetics and structures of the tilted phases of fatty acid Langmuir monolayers

    Physical Chemistry Chemical Physics, Vol. 22, Núm. 21, pp. 12092-12103

2019

  1. Energetics and structure of Langmuir monolayers of palmitic acid: A DFT study

    Physical Chemistry Chemical Physics, Vol. 21, Núm. 21, pp. 11203-11213