A Tris(triphenylphosphine)ruthenium(II) Complex as a UV Photoinitiator for Free-Radical Polymerization and in Situ Silver Nanoparticle Formation in Cationic Films

Davy-Louis Versace , Javier Cerezo Bastida , Cédric Lorenzini , Christine Cachet-Vivier
Macromolecules 46 ( 22) 8808 -8815

17
2013
On the role of entropy in the stabilization of α-Helixes

Adolfo Bastida Pascual , José Zúñiga Román , Alberto Requena Rodríguez , Beatriz Miguel Hernández
American Chemical Society

2020
Application of parallel blind docking with BINDSURF for the study of platinum derived compounds as anticancer drugs.

Baldomero Imbernon , José Pedro Cerón-Carrasco , Sonali Chavan , José M. Cecilia
IWBBIO 972 -976

2014
Quantum and semiclassical dynamical studies of nonadiabatic processes in solution: achievements and perspectives.

Lara Martinez-Fernandez , Roberto Improta , Fabrizio Santoro , Javier Cerezo
Physical Chemistry Chemical Physics 23 ( 14) 8181 -8199

2021
Intraresidual Correlated Motions in Peptide Chains.

Adolfo Bastida , Javier Carmona-García , José Zúñiga , Alberto Requena
Journal of Chemical Information and Modeling 59 ( 11) 4524 -4527

2019
On the Role of Entropy in the Stabilization of α-Helices.

Adolfo Bastida , José Zúñiga , Alberto Requena , Beatriz Miguel
Journal of Chemical Information and Modeling 60 ( 12) 6523 -6531

2020
Quantum-Classical Calculation of Vibronic Spectra along a Reaction Path: The Case of the ECD of Easily Interconvertible Conformers with Opposite Chiral Responses.

Javier Cerezo , Giuseppe Mazzeo , Giovanna Longhi , Sergio Abbate
Journal of Physical Chemistry Letters 7 ( 23) 4891 -4897

10
2016
Labelling Herceptin with a novel oxaliplatin derivative: a computational approach towards the selective drug delivery

José P. Cerón-Carrasco , Javier Cerezo , Alberto Requena , José Zuñiga
Journal of Molecular Modeling 20 ( 9) 2401

18
2014
Depth characterization by confocal raman microscopy of oxygen inhibition in free radical photopolymerization of acrylates: Contribution of the thiol chemistry

François Courtecuisse , Javier Cerezo , Céline Croutxé-Barghorn , Céline Dietlin
Journal of Polymer Science Part A: Polymer Chemistry 51 ( 3) 635 -643

22
2013
Vibronic Coupling Explains the Different Shape of Electronic Circular Dichroism and of Circularly Polarized Luminescence Spectra of Hexahelicenes

Yanli Liu , Javier Cerezo , Giuseppe Mazzeo , Na Lin
Journal of Chemical Theory and Computation 12 ( 6) 2799 -2819

54
2016
Revisiting Vertical Models To Simulate the Line Shape of Electronic Spectra Adopting Cartesian and Internal Coordinates

Javier Cerezo , Fabrizio Santoro
Journal of Chemical Theory and Computation 12 ( 10) 4970 -4985

20
2016
Accounting for Vibronic Features through a Mixed Quantum-Classical Scheme: Structure, Dynamics, and Absorption Spectra of a Perylene Diimide Dye in Solution

Alekos Segalina , Javier Cerezo , Giacomo Prampolini , Fabrizio Santoro
Journal of Chemical Theory and Computation 16 ( 11) 7061 -7077

4
2020
Modeling Solvent Broadening on the Vibronic Spectra of a Series of Coumarin Dyes. From Implicit to Explicit Solvent Models

Javier Cerezo , Francisco J. Avila Ferrer , Giacomo Prampolini , Fabrizio Santoro
Journal of Chemical Theory and Computation 11 ( 12) 5810 -5825

40
2015
Theoretical insights on the antioxidant activity of edaravone free radical scavengers derivatives

José P. Cerón-Carrasco , Hélène M. Roy , Javier Cerezo , Denis Jacquemin
Chemical Physics Letters 599 73 -79

4
2014
How DNA is damaged by external electric fields: selective mutation vs. random degradation.

José Pedro Cerón-Carrasco , Javier Cerezo , Denis Jacquemin
Physical Chemistry Chemical Physics 16 ( 18) 8243 -8246

22
2014
Theoretical investigation of the broad one-photon absorption line-shape of a flexible symmetric carbazole derivative.

Yanli Liu , Javier Cerezo , Fabrizio Santoro , Antonio Rizzo
Physical Chemistry Chemical Physics 18 ( 33) 22889 -22905

11
2016
Insights for an Accurate Comparison of Computational Data to Experimental Absorption and Emission Spectra: Beyond the Vertical Transition Approximation.

Francisco J. Avila Ferrer , Javier Cerezo , Emiliano Stendardo , Roberto Improta
Journal of Chemical Theory and Computation 9 ( 4) 2072 -2082

136
2013
Harmonic Models in Cartesian and Internal Coordinates to Simulate the Absorption Spectra of Carotenoids at Finite Temperatures.

Javier Cerezo , José Zúñiga , Alberto Requena , Francisco J. Ávila Ferrer
Journal of Chemical Theory and Computation 10 ( 11) 3586 -3587

44
2013
Optical Properties of Diarylethenes with TD-DFT: 0-0 Energies, Fluorescence, Stokes Shifts, and Vibronic Shapes.

Agisilaos Chantzis , Javier Cerezo , Aurélie Perrier , Fabrizio Santoro
Journal of Chemical Theory and Computation 10 ( 9) 3944 -3957

17
2014
The Intriguing Case of the One‐Photon and Two‐Photon Absorption of a Prototypical Symmetric Squaraine: Comparison of TDDFT and Wave‐Function Methods

Francisco J. Avila Ferrer , Celestino Angeli , Javier Cerezo , Sonia Coriani
ChemPhotoChem 3 ( 9) 778 -793

3
2019