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Robin Chaudret

Researcher at French Institute of Petroleum

Publications -  31
Citations -  3457

Robin Chaudret is an academic researcher from French Institute of Petroleum. The author has contributed to research in topics: Ab initio & Non-covalent interactions. The author has an hindex of 13, co-authored 30 publications receiving 2640 citations. Previous affiliations of Robin Chaudret include École normale supérieure de Lyon & Centre national de la recherche scientifique.

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Journal ArticleDOI

NCIPLOT: A Program for Plotting Noncovalent Interaction Regions

Julia Contreras-García, +6 more
- 08 Mar 2011 - 
TL;DR: The NCI computational algorithms and their implementation for the analysis and visualization of weak interactions, using both self-consistent fully quantum-mechanical, as well as promolecular, densities are described.
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Polarizable Molecular Dynamics Simulation of Zn(II) in Water Using the AMOEBA Force Field

Johnny Wu, +7 more
- 13 Jul 2010 - 
TL;DR: Results show that the importance of charge transfer decreases as the size of Zn-water cluster grows due to anticooperativity and to changes in the nature of the metal-ligand bonds, and should be incorporated in to the pairwise van der Waals contribution or treated explicitly.
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Unraveling non-covalent interactions within flexible biomolecules: from electron density topology to gas phase spectroscopy

Robin Chaudret, +6 more
- 06 May 2014 - 
TL;DR: The NCI technique is applied to a series of stable conformations of isolated molecules as an interpretative technique to decipher the different physical interactions at play in these systems, providing an easy tool for all chemists, experimentalists and theoreticians for the visualization and characterization of the interactions shaping complex molecular systems.
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Noncovalent Interaction Analysis in Fluctuating Environments.

Pan Wu, +3 more
- 14 May 2013 - 
TL;DR: A new Averaged NonCovalent Interaction index along with a fluctuation index is developed that can extract and visualize noncovalent interactions from thermal noise in fluctuating environments.
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Coupling quantum interpretative techniques: another look at chemical mechanisms in organic reactions.

Natacha Gillet, +6 more
- 13 Nov 2012 - 
TL;DR: Strong convergences through the reaction paths between ELF and NCI critical points enable to identify key interactions at the origin of the bond formation.