List of works - Sebastien Fiorucci

ATTRACT and PTools: open source programs for protein-protein docking

scientific article

Activation Dynamics of the Neurotensin G Protein-Coupled Receptor 1

scientific article published on 25 July 2018

Agonists of G-Protein-Coupled Odorant Receptors Are Predicted from Chemical Features.

scientific article published on 12 April 2018

Allosteric Modulation Mechanism of the mGluR5 Transmembrane Domain

scientific article published on 03 May 2019

Binding free energy prediction in strongly hydrophobic biomolecular systems.

scientific article

Bornyl-diphosphate synthase from Lavandula angustifolia: A major monoterpene synthase involved in essential oil quality

scientific article

Computational antigenic epitope prediction by calculating electrostatic desolvation penalties of protein surfaces

Conserved Residues Control the T1R3-Specific Allosteric Signaling Pathway of the Mammalian Sweet-Taste Receptor

scientific article published on 01 May 2019

DFT study of quercetin activated forms involved in antiradical, antioxidant, and prooxidant biological processes

scientific article published on 01 February 2007

Exploiting Antigenic Diversity for Vaccine Design: THE CHLAMYDIA ArtJ PARADIGM

scientific article

Fine-tuning of microsolvation and hydrogen bond interaction regulates substrate channelling in the course of flavonoid biosynthesis.

scientific article

In vivo characterization of dynein-driven nanovectors using Drosophila oocytes

scientific article (publication date: 2013)

Isolation and functional characterization of a τ-cadinol synthase, a new sesquiterpene synthase from Lavandula angustifolia

scientific article published in January 2014

Machine learning decodes chemical features to identify novel agonists of a moth odorant receptor

scientific article published on 03 February 2020

Mechanistic events underlying odorant binding protein chemoreception

scientific article published on 01 May 2007

Metal Ions Activate the Human Taste Receptor TAS2R7

scientific article published on 01 May 2019

Molecular Features Underlying the Perception of Astringency as Probed by Molecular Modeling.

scientific article published on 15 February 2011

Molecular simulations bring new insights into flavonoid/quercetinase interaction modes

scientific article published on 01 June 2007

Molecular simulations enlighten the binding mode of quercetin to lipoxygenase-3.

scientific article published in November 2008

Molecular simulations reveal a new entry site in quercetin 2,3-dioxygenase. A pathway for dioxygen?

scientific article published on 01 September 2006

Oxygenolysis of flavonoid compounds: DFT description of the mechanism for quercetin.

scientific article published in November 2004

O₂migration rates in [NiFe] hydrogenases. A joint approach combining free-energy calculations and kinetic modeling

scientific article published on 13 January 2014

PTools: an opensource molecular docking library

scientific article

ProLIF: a library to encode molecular interactions as fingerprints

scientific article published on 25 September 2021

Sweetness prediction of natural compounds

scientific article published on 03 November 2016

The anatomy of mammalian sweet taste receptors

scientific article published on 9 December 2016

Theoretical investigations of the role played by quercetinase enzymes upon the flavonoids oxygenolysis mechanism.

scientific article published on 13 January 2009

Zebrafish olfactory receptors ORAs differentially detect bile acids and bile salts

scientific article published on 04 March 2019

List of works by Sebastien Fiorucci

ATTRACT and PTools: open source programs for protein-protein docking

Activation Dynamics of the Neurotensin G Protein-Coupled Receptor 1

Agonists of G-Protein-Coupled Odorant Receptors Are Predicted from Chemical Features.

Allosteric Modulation Mechanism of the mGluR5 Transmembrane Domain

Binding free energy prediction in strongly hydrophobic biomolecular systems.

Bornyl-diphosphate synthase from Lavandula angustifolia: A major monoterpene synthase involved in essential oil quality

Computational antigenic epitope prediction by calculating electrostatic desolvation penalties of protein surfaces

Conserved Residues Control the T1R3-Specific Allosteric Signaling Pathway of the Mammalian Sweet-Taste Receptor

DFT study of quercetin activated forms involved in antiradical, antioxidant, and prooxidant biological processes

Exploiting Antigenic Diversity for Vaccine Design: THE CHLAMYDIA ArtJ PARADIGM

Fine-tuning of microsolvation and hydrogen bond interaction regulates substrate channelling in the course of flavonoid biosynthesis.

In vivo characterization of dynein-driven nanovectors using Drosophila oocytes

Isolation and functional characterization of a τ-cadinol synthase, a new sesquiterpene synthase from Lavandula angustifolia

Machine learning decodes chemical features to identify novel agonists of a moth odorant receptor

Mechanistic events underlying odorant binding protein chemoreception

Metal Ions Activate the Human Taste Receptor TAS2R7

Molecular Features Underlying the Perception of Astringency as Probed by Molecular Modeling.

Molecular simulations bring new insights into flavonoid/quercetinase interaction modes

Molecular simulations enlighten the binding mode of quercetin to lipoxygenase-3.

Molecular simulations reveal a new entry site in quercetin 2,3-dioxygenase. A pathway for dioxygen?

Oxygenolysis of flavonoid compounds: DFT description of the mechanism for quercetin.

O₂migration rates in [NiFe] hydrogenases. A joint approach combining free-energy calculations and kinetic modeling

PTools: an opensource molecular docking library

ProLIF: a library to encode molecular interactions as fingerprints

Sweetness prediction of natural compounds

The anatomy of mammalian sweet taste receptors

Theoretical investigations of the role played by quercetinase enzymes upon the flavonoids oxygenolysis mechanism.

Zebrafish olfactory receptors ORAs differentially detect bile acids and bile salts