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Lista de obras de Lorenzo Cupellini

A Quantum Chemical Interpretation of Two-Dimensional Electronic Spectroscopy of Light-Harvesting Complexes

artículo científico publicado en 2017

A Synthetic Oxygen Sensor for Plants Based on Animal Hypoxia Signaling

scientific article published on 20 November 2018

A polarizable QM/MM description of environment effects on NMR shieldings: from solvated molecules to pigment–protein complexes

An Ab Initio Description of the Excitonic Properties of LH2 and Their Temperature Dependence

artículo científico publicado en 2016

Atomic Detail of Protein Folding Revealed by an Ab Initio Reappraisal of Circular Dichroism

article published in 2018

Charge transfer from the carotenoid can quench chlorophyll excitation in antenna complexes of plants

artículo científico publicado en 2020

Coherence in carotenoid-to-chlorophyll energy transfer

scientific article published in Nature Communications

Coupling to Charge Transfer States is the Key to Modulate the Optical Bands for Efficient Light Harvesting in Purple Bacteria

artículo científico publicado en 2018

Density-Dependent Formulation of Dispersion-Repulsion Interactions in Hybrid Multiscale Quantum/Molecular Mechanics (QM/MM) Models.

artículo científico publicado en 2018

EXAT: EXcitonic analysis tool.

artículo científico publicado en 2017

Efficient Photoinduced Charge Separation in a BODIPY–C60 Dyad

Electron and excitation energy transfers in covalently linked donor-acceptor dyads: mechanisms and dynamics revealed using quantum chemistry

artículo científico publicado en 2017

Electronic Excitations in Nonpolar Solvents: Can the Polarizable Continuum Model Accurately Reproduce Solvent Effects?

artículo científico publicado en 2014

Electronic couplings for photo-induced processes from subsystem time-dependent density-functional theory: The role of the diabatization

artículo científico publicado en 2020

Electronic energy transfer in biomacromolecules

Elucidating the role of structural fluctuations, and intermolecular and vibronic interactions in the spectroscopic response of a bacteriophytochrome

artículo científico publicado en 2020

Exciton properties and optical spectra of light harvesting complex II from a fully atomistic description

artículo científico publicado en 2020

Frenkel-exciton decomposition analysis of circular dichroism and circularly polarized luminescence for multichromophoric systems.

artículo científico publicado en 2018

Is energy transfer limiting multiphotochromism? answers from ab initio quantifications

artículo científico publicado en 2016

Modeling excitation energy transfer in multi-BODIPY architectures

artículo científico publicado en 2017

Modelling excitation energy transfer in covalently linked molecular dyads containing a BODIPY unit and a macrocycle

artículo científico publicado en 2018

Molecular Mechanisms of Activation in the Orange Carotenoid Protein Revealed by Molecular Dynamics

artículo científico publicado en 2020

Photoprotection and triplet energy transfer in higher plants: the role of electronic and nuclear fluctuations

artículo científico publicado en 2016

Plasmon Enhanced Light Harvesting: Multiscale Modeling of the FMO Protein Coupled with Gold Nanoparticles

Polarizable embedding QM/MM: the future gold standard for complex (bio)systems?

artículo científico publicado en 2020

Quantum Chemical Modeling of the Photoinduced Activity of Multichromophoric Biosystems

scientific article published on 05 July 2019

Quantum chemical elucidation of a sevenfold symmetric bacterial antenna complex

artículo científico publicado en 2022

Successes & challenges in the atomistic modeling of light-harvesting and its photoregulation

scientific article published on 03 August 2019

The modeling of the absorption lineshape for embedded molecules through a polarizable QM/MM approach

artículo científico publicado en 2018

The molecular mechanisms of light adaption in light-harvesting complexes of purple bacteria revealed by a multiscale modeling

artículo científico publicado en 2019

The role of charge-transfer states in the spectral tuning of antenna complexes of purple bacteria.

artículo científico publicado en 2018

Understanding the influence of disorder on the exciton dynamics and energy transfer in Zn-phthalocyanine H-aggregates

artículo científico publicado en 2018

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