Javier Cerezo

Assistant Professor (Ayudante Doctor)

Universidad Autónoma de Madrid

Spain

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Javier Cerezo is an Assistant Professor (Ayudante Doctor) at Universidad Autónoma de Madrid, Spain. His research areas include the application of quantum mechanics in molecular systems, analysis of spectral shapes and properties, and computational biophysics. He has authored several recent articles focusing on nonbonded aggregates, luminescence spectral analysis, and the interactions of biomolecules with DNA.

Articles (20)

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2025

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2023

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2022

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2021

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2021

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2020

Collaborators (7)

Francesca Ingrosso

FRANCE

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Barbara Ventura

ITALY

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Mariachiara Pastore

FRANCE

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Daniel Aranda

University of Malaga

SPAIN

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Graham Worth

Professor of Computational Chemistry

University College London

UNITED KINGDOM

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Alberto Requena

Universidad de Murcia

SPAIN

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Cristina Garcia-Iriepa

Universidad de Alcalá

SPAIN

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Javier Cerezo

Research Interests

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About

Articles (20)

Assessing Nonbonded Aggregates Populations: Application to the Concentration-Dependent IR O–H Band of Phenol

JOYCE3.0: A General Protocol for the Specific Parametrization of Accurate Intramolecular Quantum Mechanically Derived Force Fields

Deciphering the Luminescence Spectral Shape of an Oxyluciferin Analogue through a Mixed Quantum-Classical Approach

Correction to “Ab Initio Partition Functions and Thermodynamic Quantities for the Molecular Hydrogen Isotopologues”

Non-adiabatic direct quantum dynamics using force fields: Toward solvation

Cover Feature: Explicit Modelling of Spectral Bandshapes by a Mixed Quantum‐Classical Approach: Solvent Order and Temperature Effects in the Optical Spectra of Distyrylbenzene (ChemPhysChem 16/2024)

Explicit Modelling of Spectral Bandshapes by a Mixed Quantum‐Classical Approach: Solvent Order and Temperature Effects in the Optical Spectra of Distyrylbenzene

Unveiling the interaction modes of Imiquimod with DNA: Biophysical and computational studies

Dynamic effects on the nonlinear optical properties of donor acceptor stenhouse adducts: insights from combined MD + QM simulations

Influence of symmetry breaking on the absorption spectrum of crystal violet: from isolated cations at 5 K to room temperature solutions

Non-Phenomenological Description of the Time-Resolved Emission in Solution with Quantum–Classical Vibronic Approaches—Application to Coumarin C153 in Methanol

The Resonance Raman Spectrum of Cytosine in Water: Analysis of the Effect of Specific Solute–Solvent Interactions and Non-Adiabatic Couplings

Vibrationally resolved two-photon electronic spectra including vibrational pre-excitation: Theory and application to VIPER spectroscopy with two-photon excitation

FCclasses3: Vibrationally‐resolved spectra simulated at the edge of the harmonic approximation

Unraveling the contributions to the spectral shape of flexible dyes in solution: insights on the absorption spectrum of an oxyluciferin analogue

Nonadiabatic Vibrational Resonance Raman Spectra from Quantum Dynamics Propagations with LVC Models. Application to Thymine

Turn on Fluorescence Sensing of Zn2+ Based on Fused Isoindole-Imidazole Scaffold

Ab Initio Partition Functions and Thermodynamic Quantities for the Molecular Hydrogen Isotopologues

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

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

Collaborators (7)

Francesca Ingrosso

Barbara Ventura

Mariachiara Pastore

Daniel Aranda

Graham Worth

Alberto Requena

Cristina Garcia-Iriepa

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