Elise Duboué-Dijon (E Duboué-Dijon)

ORCID

Publication Activity (10 Years)

Years Active: 2017-2024
Publications (10 Years): 17

Top Venues

Physical chemistry chemical physics : PCCP

The journal of physical chemistry. B

The journal of physical chemistry letters

The Journal of chemical physics

Laboratoire de Biochimie Théorique

Universite Pierre et Marie Curie (PHD)

This page only lists publications with an associated author ORCID identifier.

Affiliation History

Laboratoire de Biochimie Théorique Oct 01 2018

France

Chargée de recherche CNRS

Institute of Organic Chemistry and Biochemistry AS CR (IOCB) Jan 01 2016 - Sep 30 2018

Czechia

Post-doctoral fellow

École Normale Supérieure Jan 09 2012 - Dec 31 2016

France

Ph D student :: Chemistry

Education History

Universite Pierre et Marie Curie Sep 01 2012 - Sep 14 2015

France

PHD :: Chemistry

Universite Pierre et Marie Curie Sep 01 2010 - Jun 30 2012

France

MSC

Publications

Elisa Frezza, Damien Laage, Elise Duboué-Dijon
Molecular Origin of Distinct Hydration Dynamics in Double Helical DNA and RNA Sequences. The journal of physical chemistry letters (2024)
Philip E Mason, Tomas Martinek, Balázs Fábián, Mario Vazdar, Pavel Jungwirth, Ondrej Tichacek, Elise Duboué-Dijon, Hector Martinez-Seara
Hydration of biologically relevant tetramethylammonium cation by neutron scattering and molecular dynamics. Physical chemistry chemical physics : PCCP (2024)
Philip E Mason, Tomas Martinek, Balázs Fábián, Mario Vazdar, Pavel Jungwirth, Ondrej Tichacek, Elise Duboué-Dijon, Hector Martinez-Seara
Hydration of biologically relevant tetramethylammonium cation by neutron scattering and molecular dynamics. Physical chemistry chemical physics : PCCP 26 (4) (2024)
Sélène Forget, Marie Juillé, Elise Duboué-Dijon, Guillaume Stirnemann
Simulation-Guided Conformational Space Exploration to Assess Reactive Conformations of a Ribozyme. Journal of chemical theory and computation 20 (14) (2024)
Philip E Mason, Tomas Martinek, Balázs Fábián, Mario Vazdar, Pavel Jungwirth, Ondrej Tichacek, Elise Duboué-Dijon, Hector Martinez-Seara
Hydration of biologically relevant tetramethylammonium cation by neutron scattering and molecular dynamics. Physical chemistry chemical physics : PCCP 26 (4) (2024)
Sélène Forget, Marie Juillé, Elise Duboué-Dijon, Guillaume Stirnemann
Simulation-Guided Conformational Space Exploration to Assess Reactive Conformations of a Ribozyme. Journal of chemical theory and computation (2024)
Elisa Frezza, Damien Laage, Elise Duboué-Dijon
Molecular Origin of Distinct Hydration Dynamics in Double Helical DNA and RNA Sequences. The journal of physical chemistry letters 15 (16) (2024)
Philip E Mason, Tomas Martinek, Balázs Fábián, Mario Vazdar, Pavel Jungwirth, Ondrej Tichacek, Elise Duboué-Dijon, Hector Martinez-Seara
Hydration of biologically relevant tetramethylammonium cation by neutron scattering and molecular dynamics. Physical chemistry chemical physics : PCCP 26 (4) (2024)
Julie Puyo-Fourtine, Marie Juillé, Jérôme Hénin, Carine Clavaguéra, Elise Duboué-Dijon
Consistent Picture of Phosphate-Divalent Cation Binding from Models with Implicit and Explicit Electronic Polarization. The journal of physical chemistry. B 126 (22) (2022)
Elise Duboué-Dijon, Jérôme Hénin
Building intuition for binding free energy calculations: Bound state definition, restraints, and symmetry. The Journal of chemical physics 154 (20) (2021)
Elise Duboué-Dijon, Matti Javanainen, Pauline Delcroix, Pavel Jungwirth, Hector Martinez-Seara
A practical guide to biologically relevant molecular simulations with charge scaling for electronic polarization. The Journal of chemical physics 153 (5) (2021)
Denilson Mendes de Oliveira, Samual R Zukowski, Vladimir Palivec, Jérôme Hénin, Hector Martinez-Seara, Dor Ben-Amotz, Pavel Jungwirth, Elise Duboué-Dijon
Binding of divalent cations to acetate: molecular simulations guided by Raman spectroscopy. Physical chemistry chemical physics : PCCP 22 (41) (2020)
Philip E Mason, Pavel Jungwirth, Elise Duboué-Dijon
Quantifying the Strength of a Salt Bridge by Neutron Scattering and Molecular Dynamics. The journal of physical chemistry letters 10 (12) (2019)
Elise Duboué-Dijon, Pauline Delcroix, Hector Martinez-Seara, Jana Hladílková, Pavel Coufal, Tomáš Křížek, Pavel Jungwirth
Binding of Divalent Cations to Insulin: Capillary Electrophoresis and Molecular Simulations. The journal of physical chemistry. B 122 (21) (2018)
Tomas Martinek, Elise Duboué-Dijon, Štěpán Timr, Philip E Mason, Katarina Baxová, Henry E Fischer, Burkhard Schmidt, Eva Pluhařová, Pavel Jungwirth
Calcium ions in aqueous solutions: Accurate force field description aided by ab initio molecular dynamics and neutron scattering. The Journal of chemical physics 148 (22) (2018)
Kryštof Březina, Elise Duboué-Dijon, Vladimír Palivec, Jiří Jiráček, Tomáš Křížek, Cristina M Viola, Timothy R Ganderton, Andrzej Marek Brzozowski, Pavel Jungwirth
Can Arginine Inhibit Insulin Aggregation? A Combined Protein Crystallography, Capillary Electrophoresis, and Molecular Simulation Study. The journal of physical chemistry. B 122 (44) (2018)
Guillaume Stirnemann, Elise Duboué-Dijon, Damien Laage
Ab Initio Simulations of Water Dynamics in Aqueous TMAO Solutions: Temperature and Concentration Effects. The journal of physical chemistry. B 121 (49) (2017)

Elise Duboué-Dijon.css-eqlu8i{font-size:small;padding-left:4px;} (E Duboué-Dijon)

Publication Activity (10 Years)

Top Topics

Top Venues

Elise Duboué-Dijon (E Duboué-Dijon)