Publicaciones en colaboración con investigadores/as de Universidad de La Rioja (24)

2023

  1. Conformationally Restricted β-Sheet Breaker Peptides Incorporating Cyclic α-Methylisoserine Sulfamidates

    Chemistry - A European Journal, Vol. 29, Núm. 9

2022

  1. Fluorination and deoxygenation as chemical tools to study the conformational preferences of hexopyranoses: a journey from gas phase to solution

    75th International Symposium on Molecular Spectroscopy

2021

  1. Laboratory Observation of, Astrochemical Search for, and Structure of Elusive Erythrulose in the Interstellar Medium

    Journal of Physical Chemistry Letters, Vol. 12, Núm. 4, pp. 1352-1359

  2. Molecular ruler mechanism and interfacial catalysis of the integral membrane acyltransferase PatA

    Science Advances, Vol. 7, Núm. 42

2020

  1. Observation of the Unbiased Conformers of Putative DNA-Scaffold Ribosugars

    ACS Central Science, Vol. 6, Núm. 2, pp. 293-303

2019

  1. Conformational Behavior of D-Lyxose in Gas and Solution Phases by Rotational and NMR Spectroscopies

    Journal of Physical Chemistry Letters, Vol. 10, Núm. 12, pp. 3339-3345

2018

  1. Water Sculpts the Distinctive Shapes and Dynamics of the Tumor-Associated Carbohydrate Tn Antigens: Implications for Their Molecular Recognition

    Journal of the American Chemical Society, Vol. 140, Núm. 31, pp. 9952-9960

2017

  1. Conformational study of DNA sugars: from the gas phase to solution

    72nd International Symposium on Molecular Spectroscopy

  2. Untangling Tn antigen structure and its first hydration shell

    28th Joint Glycobiology Meeting 2017

2016

  1. 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

2015

  1. Structural Distortion of the Epoxy Groups in Norbornanes: A Rotational Study of exo-2,3-Epoxynorbornane

    ChemPhysChem, Vol. 16, Núm. 12, pp. 2609-2614

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. Formation of water polyhedrons in propofol-water clusters

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

  2. Magic numbers in the solvation of the propofol dimer

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

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

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

  4. 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

  5. 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