CNRS research associates

Chris Chipot

CNRS research director

Research interests: Free-energy calculations, membrane simulations.

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François Dehez

CNRS research associate

Research interests: Membrane simulations, intermolecular potentials.

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Administrative staff

Francis Hoffmann

System administrator



Former associates

Jeff Comer

Jeff Comer

Research interests: Statistical mechanics simulations, free-energy calculations.

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axel_bidon_chanal

Axel Bidon-Chanal Badia

Research interests: Modeling of protein-membrane interaction, free-energy calculations in biological systems, drug design.

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Nicole

Nicole Holzmann

Postdoctoral fellow

Research interests: Membrane Simulations, Bonding Analysis, EDA-NOCV

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Vijay

Vijayaraj Ramadoss

Postdoctoral fellow

Research interests: Modeling of biomolecular interactions, Free energy calculations of biological systems. Computational redesigning of enzyme specificity, Multidimensional quantitative structure activity relationship.

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Recent publications

Bignon, E.; Gattuso, H.; Morell, C.; Dehez, F.; Georgakilas, A. G.; Monari, A. & Dumont, E.
Correlation of bistranded clustered abasic DNA lesion processing with structural and dynamic DNA helix distortion.
Nucleic Acids Res.

2016,  (44), 8588-8599.
dx.doi.org

Wang, S.; Zhao, T.; Shao, X.; Chipot, C.; Cai, W.
Complex movements in rotaxanes: Shuttling coupled with conformational transition of cyclodextrins
J. Phys. Chem. C

2016,  (120), 19479-19486.
dx.doi.org

Gattuso, H.; Durand, E.; Bignon, E.; Morell, C.; Georgakilas, A. G.; Dumont, E.; Chipot, C.; Dehez, F.; Monari, A.
Repair rate of clustered abasic DNA lesions by human endonuclease: Molecular bases of sequence specificity
J. Phys. Chem. Lett

2016,  (19), 3760-3765.
dx.doi.org

News

- Renewal of the Laboratoire International Associé CNRS-University of Illinois at Urbana-Champaign on November 2016
- An update of ParseFEP is available in the latest version of VMD.
- 新的分子动力学讲义 (Dissemination).
 

Contact

Laboratoire International Associé
CNRS-UIUC
Unité mixte de recherche n°7565
Université de Lorraine, B.P. 70239
54506 Vandoeuvre-lès-Nancy Cedex, France
 
Phone: +33.(0)3.83.68.40.97
Fax: +33.(0)3.83.68.43.87
 
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