Publicaciones en las que colabora con Emilio José Cocinero Pérez (38)
2018
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Phenyl-β-D-glucopyranoside and phenyl-β-D-galactopyranoside Dimers: Small structural differences but very different interactions
Frontiers in Physics, Vol. 5, Núm. FEB
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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
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High conductance values in π-folded molecular junctions
Nature Communications, Vol. 8
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Influence of the Anomeric Conformation in the Intermolecular Interactions of Glucose
Journal of Physical Chemistry Letters, Vol. 8, Núm. 6, pp. 1147-1151
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Structural Studies of Nicotinoids: Cotinine versus Nicotine
Chemistry - A European Journal
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Structural Studies of Nicotinoids: Cotinine versus Nicotine
Chemistry - A European Journal, Vol. 23, Núm. 30, pp. 7238-7244
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Understanding the role of tyrosine in glycogenin
Molecular BioSystems, Vol. 13, Núm. 9, pp. 1709-1712
2016
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Modeling the tyrosine-sugar interactions in supersonic expansions: Glucopyranose-phenol clusters
Physical Chemistry Chemical Physics, Vol. 18, Núm. 18, pp. 12457-12465
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Potential energy surface of fluoroxene: Experiment and theory
Physical Chemistry Chemical Physics, Vol. 18, Núm. 5, pp. 3966-3974
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Scopine Isolated in the Gas Phase
ChemPhysChem, Vol. 17, Núm. 19, pp. 3030-3034
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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
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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
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Elucidating the structure of sugars in the gas phase
XI Carbohydrate Symposium
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Mimicking anesthetic-receptor interactions in jets: The propofol-isopropanol cluster
Physical Chemistry Chemical Physics, Vol. 16, Núm. 32, pp. 16968-16975
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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
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O-H⋯N and C-H⋯O hydrogen bonds control hydration of pivotal tropane alkaloids: Tropinone⋯H2O complex
ChemPhysChem, Vol. 15, Núm. 5, pp. 918-923
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Water encapsulation by nanomicelles
Angewandte Chemie International, Vol. 53, Núm. 46, pp. 12480-12483
2013
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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
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Formation of water polyhedrons in propofol-water clusters
Physical Chemistry Chemical Physics, Vol. 15, Núm. 2, pp. 568-575
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Free fructose is conformationally locked
Journal of the American Chemical Society, Vol. 135, Núm. 7, pp. 2845-2852