List of works by José A Fernandez

A spectroscopic and computational study of propofol dimers and their hydrated clusters

scientific article published on 23 September 2012

Anatomical distribution of lipids in human brain cortex by imaging mass spectrometry.

scientific article

Behind the reactivity of lactones: a computational and spectroscopic study of phenol·γ-butyrolactone.

scientific article published on 28 March 2014

Combined experimental and theoretical study of the benzocaine/Ar van der Waals system in supersonic expansions.

scientific article

Competition between stacked and hydrogen bonded structures of cytosine aggregates.

scientific article

Conformational behaviour, hydrogen bond competition and intramolecular dynamics in vanillin derivatives: acetovanillone and 6-hydroxy-3-methoxyacetophenone

scientific article published on 27 June 2011

Conformational equilibria in vanillin and ethylvanillin.

scientific article published on 19 August 2010

Crystallization and preliminary crystallographic analysis of merohedrally twinned crystals of MJ0729, a CBS-domain protein from Methanococcus jannaschii.

scientific article published on 7 June 2008

Evaluation of the aggregation process in a mixture of propofol and benzocaine

scientific article published on 01 February 2019

Excited state dynamics of aniline homoclusters

scientific article published on 01 February 2019

Exploration of the theobromine-water dimer: comparison with DNA microhydration

scientific article published on 06 July 2020

Exploring Caffeine-Phenol Interactions by the Inseparable Duet of Experimental and Theoretical Data

scientific article published on 09 October 2019

Exploring microsolvation of the anesthetic propofol.

scientific article published on 22 February 2012

Femtosecond Excited State Dynamics of Size Selected Neutral Molecular Clusters

scientific article

Formation of water polyhedrons in propofol-water clusters.

scientific article

High conductance values in π-folded molecular junctions

scientific article

IR mass-resolved spectroscopy of complexes without chromophore: cyclohexanol·(H2O)n, n = 1-3 and cyclohexanol dimer

scientific article

Influence of Lipid Fragmentation in the Data Analysis of Imaging Mass Spectrometry Experiments

scientific article published on 20 February 2020

Influence of dispersive forces on the final shape of a reverse micelle

scientific article published on 8 December 2014

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

scientific article

Influence of the Cation Adducts in the Analysis of Matrix-Assisted Laser Desorption Ionization Imaging Mass Spectrometry Data from Injury Models of Rat Spinal Cord.

scientific article published on 13 July 2017

Influence of the solvent in the electronic excitation of aromatic alcohols: Excited state IR-UV of propofol(H2O)8

scientific article published on 01 June 2019

Mass resolved IR spectroscopy of aniline-water aggregates.

scientific article published in October 2016

Mass spectrometry coupled to imaging techniques: the better the view the greater the challenge.

scientific article published on 22 January 2015

Mass-resolved infrared spectroscopy of complexes without chromophore by nonresonant femtosecond ionization detection.

scientific article

Matrix Sublimation Device for MALDI Mass Spectrometry Imaging

scientific article published on 18 December 2018

Matrix-assisted laser desorption ionization imaging mass spectrometry in lipidomics.

scientific article

Microarray and Mass Spectrometry-Based Methodology for Lipid Profiling of Tissues and Cell Cultures

scientific article published on 05 December 2019

Microhydration of Phenyl Formate: Gas‐Phase Laser Spectroscopy, Microwave Spectroscopy, and Quantum Chemistry Calculations

scientific article published in 2022

Mimicking anaesthetic-receptor interaction: a combined spectroscopic and computational study of propofol···phenol.

scientific article published on 19 April 2012

Mimicking anesthetic-receptor interactions in jets: the propofol-isopropanol cluster

scientific article

Modeling the tyrosine-sugar interactions in supersonic expansions: glucopyranose-phenol clusters

scientific article

Molecular hydration of propofol dimers in supersonic expansions: formation of active centre-like structures.

scientific article

Neurotransmitter receptor localization: from autoradiography to imaging mass spectrometry.

scientific article

O-H⋅⋅⋅N and C-H⋅⋅⋅O hydrogen bonds control hydration of pivotal tropane alkaloids: tropinone⋅⋅⋅H(2)O complex

scientific article published on 24 February 2014

Potential energy surface of fluoroxene: experiment and theory

scientific article published on 15 January 2016

Purification, crystallization and preliminary X-ray diffraction analysis of the CBS-domain pair from the Methanococcus jannaschii protein MJ0100

scientific article

Revisiting the spectroscopy of xanthine derivatives: theobromine and theophylline

scientific article published on 01 December 2019

Ribose found in the gas phase

scientific article published on 28 December 2011

Rotational spectroscopy of antipyretics: conformation, structure, and internal dynamics of phenazone

scientific article published on 01 March 2013

Scopine Isolated in the Gas Phase.

scientific article

Six pyranoside forms of free 2-deoxy-D-ribose.

scientific article

Stepwise Nucleation of Aniline: Emergence of Spectroscopic Fingerprints of the Liquid Phase

scientific article published on 28 June 2018

Structural distortion of the epoxy groups in norbornanes: a rotational study of exo-2,3-epoxynorbornane

scientific article published on 16 July 2015

Sugar-peptidic bond interactions: spectroscopic characterization of a model system.

scientific article published on 26 April 2017

Transition from planar to nonplanar hydrogen bond networks in the solvation of aromatic dimers: propofol2-(H2O)(2-4).

scientific article

Understanding the role of tyrosine in glycogenin

scientific article published on 01 August 2017

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

scientific article

Unravelling Protein-DNA Interactions at Molecular Level: A DFT and NCI Study

scientific article published on 27 January 2016

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

scientific article published on 30 July 2018

Water encapsulation by nanomicelles

scientific article published on 17 July 2014

ZEKE-PFI spectroscopy of benzocaine.

scientific article

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