Elise Duboué-Dijon

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Université Paris Cité

France

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Open Date: 2016-12-01

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In vivo effects of ions and neurotransmitters on insulin self-association in secretory granules: Molecular modeling guides the experiment.

Open Date: 2016-01-01

Close Date: 2018-01-01

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Interactions between biomolecules and their environment: from hydration dynamics to enzyme catalysis

Open Date: 2015-12-01

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Articles (5)

Year:

2022

Year:

2021

Year:

2021

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2020

Year:

2020

Collaborators (2)

Jérôme Hénin

CNRS

FRANCE

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Carine Clavaguéra

FRANCE

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Elise Duboué-Dijon

Research Interests

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Contact this professor

Recent Grants

Articles (5)

Consistent Picture of Phosphate–Divalent Cation Binding from Models with Implicit and Explicit Electronic Polarization

Building intuition for binding free energy calculations: Bound state definition, restraints, and symmetry

Publisher’s Note: “Building intuition for binding free energy calculations: Bound state definition, restraints, and symmetry” [J. Chem. Phys. 154, 204101 (2021)]

Binding of divalent cations to acetate: molecular simulations guided by Raman spectroscopy

A practical guide to biologically relevant molecular simulations with charge scaling for electronic polarization

Collaborators (2)

Jérôme Hénin

Carine Clavaguéra

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