Elise Duboué-Dijon

4PUBLICATIONS
6CO-AUTHORS
Statistical mechanics, physical combinatorics and mathematical aspects of condensed matterTheoretical quantum chemistryChemical thermodynamics and energetics
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Publications (4)

|Jul 09, 2021
Building intuition for binding free energy calculations: Bound state definition, restraints, and symmetry.

E Duboué-Dijon, J Hénin

|Aug 11, 2020
A practical guide to biologically relevant molecular simulations with charge scaling for electronic polarization.

E Duboué-Dijon, M Javanainen, P Delcroix

|Jun 17, 2018
Calcium ions in aqueous solutions: Accurate force field description aided by ab initio molecular dynamics and neutron scattering.

Tomas Martinek, Elise Duboué-Dijon, Štěpán Timr

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Frequent Collaborators

2 joint publications

Pavel Jungwirth

2 joint publications

J Hénin

1 joint publications

M Javanainen

1 joint publications

P Delcroix