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List of works by Federico Melaccio

A conical intersection controls the deactivation of the bacterial luciferase fluorophore

scientific article published on 14 July 2014

An Average Solvent Electrostatic Configuration Protocol for QM/MM Free Energy Optimization: Implementation and Application to Rhodopsin Systems

scientific article published on 7 November 2017

Comparative Quantum Chemical Studies of the Ultrafast Isomerization of Microbial, Invertebrate and Vertebrate Rhodopsins

Comparison of the isomerization mechanisms of human melanopsin and invertebrate and vertebrate rhodopsins

scientific article published on 21 January 2014

Computational Photobiology and Beyond

article published in 2010

Computational Photochemistry and Photobiology

Mapping the Excited State Potential Energy Surface of a Retinal Chromophore Model with Multireference and Equation-of-Motion Coupled-Cluster Methods

scientific article published on 6 September 2013

Modulation of thermal noise and spectral sensitivity in Lake Baikal cottoid fish rhodopsins

scientific article (publication date: 9 December 2016)

Molecular bases for the selection of the chromophore of animal rhodopsins

scientific article

Origin of Fluorescence in 11-cis Locked Bovine Rhodopsin

scientific article published on 31 July 2012

Quantum chemical modeling of rhodopsin mutants displaying switchable colors

scientific article

Shape of Multireference, Equation-of-Motion Coupled-Cluster, and Density Functional Theory Potential Energy Surfaces at a Conical Intersection

scientific article published on 11 June 2014

Space and Time Evolution of the Electrostatic Potential During the Activation of a Visual Pigment.

scientific article published on 20 June 2016

Toward Automatic Rhodopsin Modeling as a Tool for High-Throughput Computational Photobiology.

scientific article published on 25 October 2016

Unique QM/MM potential energy surface exploration using microiterations

Using the computer to understand the chemistry of conical intersections

scientific article published on 04 March 2011

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