Iker León Ona-rekin lankidetzan egindako argitalpenak (19)

2018

  1. Phenyl-β-D-glucopyranoside and phenyl-β-D-galactopyranoside Dimers: Small structural differences but very different interactions

    Frontiers in Physics, Vol. 5, Núm. FEB

2017

  1. Influence of the Anomeric Conformation in the Intermolecular Interactions of Glucose

    Journal of Physical Chemistry Letters, Vol. 8, Núm. 6, pp. 1147-1151

  2. Understanding the role of tyrosine in glycogenin

    Molecular BioSystems, Vol. 13, Núm. 9, pp. 1709-1712

2016

  1. Modeling the tyrosine-sugar interactions in supersonic expansions: Glucopyranose-phenol clusters

    Physical Chemistry Chemical Physics, Vol. 18, Núm. 18, pp. 12457-12465

  2. Unravelling Protein–DNA Interactions at Molecular Level: A DFT and NCI Study

    Journal of Chemical Theory and Computation, Vol. 12, Núm. 2, pp. 523-534

2014

  1. Mimicking anesthetic-receptor interactions in jets: The propofol-isopropanol cluster

    Physical Chemistry Chemical Physics, Vol. 16, Núm. 32, pp. 16968-16975

  2. Molecular Hydration of Propofol Dimer in Supersonic Expansions: Formation of Active Centre-Like Structures

    Physical Chemistry Chemical Physics, Vol. 16, Núm. 42, pp. 23301-23307

  3. Water encapsulation by nanomicelles

    Angewandte Chemie International, Vol. 53, Núm. 46, pp. 12480-12483

2013

  1. A subtle interplay between hydrogen bonds and dispersive interactions gives the final shape to a micelle

    Angewandte Chemie International, Vol. 52, Núm. 30, pp. 7772-7775

  2. Formation of water polyhedrons in propofol-water clusters

    Physical Chemistry Chemical Physics, Vol. 15, Núm. 2, pp. 568-575

  3. Magic numbers in the solvation of the propofol dimer

    ChemPhysChem, Vol. 14, Núm. 8, pp. 1558-1562

  4. Shaping micelles: The interplay between hydrogen bonds and dispersive interactions

    Angewandte Chemie International, Vol. 52, Núm. 30, pp. 7772-7775

  5. Transition from planar to nonplanar hydrogen bond networks in the solvation of aromatic dimers: Propofol2-(H2O)2-4

    Journal of Physical Chemistry. A, Molecules, Spectroscopy, Kinetics, Environment & General Theory, Vol. 117, Núm. 16, pp. 3396-3404

  6. Unraveling the benzocaine-receptor interaction at molecular level using mass-resolved spectroscopy

    Journal of Physical Chemistry B, Vol. 117, Núm. 43, pp. 13472-13480

2012

  1. A combined spectroscopic and theoretical study of propofol·(H 2O) 3

    Journal of Chemical Physics, Vol. 137, Núm. 7, pp. 074303

  2. A spectroscopic approach to the solvation of anesthetics in jets: Propofol(H2O)n, n = 4-6

    Journal of Physical Chemistry A, Vol. 116, Núm. 36, pp. 8934-8941

  3. Exploring microsolvation of the anesthetic propofol

    Physical Chemistry Chemical Physics, Vol. 14, Núm. 13, pp. 4398-4409

  4. Mimicking anaesthetic-receptor interaction: A combined spectroscopic and computational study of propofol⋯phenol

    Physical Chemistry Chemical Physics, Vol. 14, Núm. 25, pp. 8956-8963

2009

  1. Molecular recognition in the gas phase: benzocaine-phenol as a model of anaesthetic-receptor interaction

    Physical Chemistry Chemical Physics, Vol. 11, Núm. 48, pp. 11608-11616