Articles with public access mandates - Alberto RequenaLearn more
Not available anywhere: 16
Assessing the importance of proton transfer reactions in DNA
D Jacquemin, J Zuniga, A Requena, JP Céron-Carrasco
Accounts of chemical research 47 (8), 2467-2474, 2014
Mandates: European Commission, Government of Spain
Harmonic models in cartesian and internal coordinates to simulate the absorption spectra of carotenoids at finite temperatures
J Cerezo, J Zuniga, A Requena, FJ Avila Ferrer, F Santoro
Journal of Chemical Theory and Computation 9 (11), 4947-4958, 2013
Mandates: Government of Spain, Government of Italy
Theoretical study of the low-lying excited states of β-carotene isomers by a multireference configuration interaction method
JP Cerón-Carrasco, A Requena, CM Marian
Chemical Physics 373 (1-2), 98-103, 2010
Mandates: German Research Foundation
DFT Simulation of structural and optical properties of 9-aminoacridine half-sandwich Ru (II), Rh (III), and Ir (III) antitumoral complexes and their interaction with DNA
JP Cerón-Carrasco, J Ruiz, C Vicente, C de Haro, D Bautista, J Zuniga, ...
Journal of Chemical Theory and Computation 13 (8), 3898-3910, 2017
Mandates: Government of Spain
Conformational changes of β-carotene and zeaxanthin immersed in a model membrane through atomistic molecular dynamics simulations
J Cerezo, J Zúñiga, A Bastida, A Requena, JP Ceron-Carrasco
Physical Chemistry Chemical Physics 15 (17), 6527-6538, 2013
Mandates: Government of Spain
Atomistic molecular dynamics simulations of the interactions of oleic and 2-hydroxyoleic acids with phosphatidylcholine bilayers
J Cerezo, J Zuniga, A Bastida, A Requena, JP Ceron-Carrasco
The Journal of Physical Chemistry B 115 (40), 11727-11738, 2011
Mandates: Government of Spain
Rovibrational energies, partition functions and equilibrium fractionation of the CO2 isotopologues
J Cerezo, A Bastida, A Requena, J Zúñiga
Journal of Quantitative Spectroscopy and Radiative Transfer 147, 233-251, 2014
Mandates: Government of Spain
Theoretical Study of the Temperature Dependence of the Vibrational Relaxation of the H2O Bend Fundamental in Liquid Water and the Subsequent Distortion of …
B Miguel, J Zuniga, A Requena, A Bastida
The Journal of Physical Chemistry B 118 (31), 9427-9437, 2014
Mandates: Government of Spain
Conformational changes of trialanine in water induced by vibrational relaxation of the amide i mode
A Bastida, J Zuniga, A Requena, B Miguel, ME Candela, MA Soler
The Journal of Physical Chemistry B 120 (2), 348-357, 2016
Mandates: Government of Spain
Using the Screened Coulomb Potential to illustrate the variational method
J Zuniga, A Bastida, A Requena
Journal of Chemical Education 89 (9), 1152-1158, 2012
Mandates: Government of Spain
Tuning the optical properties of novel antitumoral drugs based on cyclometalated iridium (III) complexes
JP Cerón-Carrasco, J Zúñiga, A Requena
The Journal of Physical Chemistry A 123 (40), 8644-8649, 2019
Mandates: Government of Spain
Quantum description of linearly coupled harmonic oscillator systems using oblique coordinates
J Zúñiga, A Bastida, A Requena
Journal of Physics B: Atomic, Molecular and Optical Physics 53 (2), 025101, 2019
Mandates: Government of Spain
A spectroscopic potential energy surface for FCN
J Zúñiga, JAG Picón, A Bastida, A Requena
Journal of Quantitative Spectroscopy and Radiative Transfer 113 (11), 1155-1169, 2012
Mandates: Government of Spain
Quantum treatment of Hénon–Heiles systems using oblique coordinates
J Zúñiga, A Bastida, A Requena
Journal of Physics B: Atomic, Molecular and Optical Physics 50 (2), 025101, 2016
Mandates: Government of Spain
Understanding the connection between conformational changes of peptides and equilibrium thermal fluctuations
MA Soler, J Zúñiga, A Requena, A Bastida
Physical Chemistry Chemical Physics 19 (5), 3459-3463, 2017
Mandates: Government of Spain
Theoretical vibrational terms and rotational constants for the 15N substituted isotopologues of N2O calculated using normal hyperspherical coordinates
J Zúñiga, A Bastida, A Requena
Journal of Quantitative Spectroscopy and Radiative Transfer 113 (1), 26-46, 2012
Mandates: Government of Spain
Available somewhere: 27
Si-bearing molecules toward IRC+ 10216: ALMA unveils the molecular envelope of CWLeo
LV Prieto, J Cernicharo, G Quintana-Lacaci, M Agúndez, A Castro-Carrizo, ...
The Astrophysical journal letters 805 (2), L13, 2015
Mandates: European Commission, Government of Spain
Antioxidant properties of β-carotene isomers and their role in photosystems: insights from ab initio simulations
J Cerezo, J Zúñiga, A Bastida, A Requena, JP Ceron-Carrasco, ...
The Journal of Physical Chemistry A 116 (13), 3498-3506, 2012
Mandates: Government of Spain
A new fluorescence turn-on chemosensor for nanomolar detection of Al 3+ constructed from a pyridine–pyrazole system
B Naskar, K Das, RR Mondal, DK Maiti, A Requena, JP Cerón-Carrasco, ...
New Journal of Chemistry 42 (4), 2933-2941, 2018
Mandates: Government of Spain
Hints of a rotating spiral structure in the innermost regions around IRC+ 10216
G Quintana-Lacaci, J Cernicharo, M Agúndez, LV Prieto, A Castro-Carrizo, ...
The Astrophysical Journal 818 (2), 192, 2016
Mandates: European Commission, Government of Spain
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