about
Electronic spectrum of the AlC(2) radical.The chemistry of bioluminescence: an analysis of chemical functionalities.Photostability Mechanisms in Human γB-Crystallin: Role of the Tyrosine Corner Unveiled by Quantum Mechanics and Hybrid Quantum Mechanics/Molecular Mechanics Methodologies.Probing protein mechanics: residue-level properties and their use in defining domains.Are the bio- and chemiluminescence states of the firefly oxyluciferin the same as the fluorescence state?Chemiluminescence and Fluorescence States of a Small Model for Coelenteramide and Cypridina Oxyluciferin: A CASSCF/CASPT2 Study.cis influence in models of cobalt corrins by DFT and TD-DFT studies.The synthesis of a corrole analogue of aquacobalamin (vitamin B12a) and its ligand substitution reactions.The preparation of N-acetyl-Co(III)-microperoxidase-8 (NAcCoMP8) and its ligand substitution reactions: a comparison with aquacobalamin (vitamin B(12a)).Myosin flexibility: structural domains and collective vibrations.Mechanistic investigations of the 2-coumaranone chemiluminescence.Hybrid QM/MM simulations of the obelin bioluminescence and fluorescence reveal an unexpected light emitter.QM/MM calculations on a newly synthesised oxyluciferin substrate: new insights into the conformational effect.QM/MM Study of the Formation of the Dioxetanone Ring in Fireflies Through a Superoxide Ion.Chemi- and Bioluminescence of Cyclic Peroxides.Simulation and Analysis of the Spectroscopic Properties of Oxyluciferin and Its Analogues in WaterChemiluminescence of Coelenterazine and Fluorescence of Coelenteramide: A Systematic Theoretical StudySystematic Theoretical Investigation on the Light Emitter of FireflyBeetle luciferases with naturally red- and blue-shifted emissionEffect of Protein Conformation and AMP Protonation State on Fireflies' Bioluminescent EmissionVibrations in the B4 rhombic structureDFT studies of trans and cis influences in the homolysis of the Co-C bond in models of the alkylcobalaminsBioluminescent Nanoluciferase-Furimamide Complex: A Theoretical Study on Different Protonation StatesFungal Light Emitter: Understanding Its Chemical Nature and pH-Dependent Emission in Water SolutionMolecular Simulations with in-deMon2k QM/MM, a Tutorial-ReviewLight emission colour modulation study of oxyluciferin synthetic analogues via QM and QM/MM approaches
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description
researcher
@en
name
Isabelle Navizet
@en
Isabelle Navizet
@nl
type
label
Isabelle Navizet
@en
Isabelle Navizet
@nl
prefLabel
Isabelle Navizet
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Isabelle Navizet
@nl
P106
P31
P4450
isabelle-navizet
P496
0000-0002-2158-6157