Ananlysis of transition mechanisms of molecular motors by quantum mechanics

Vercauteren, Daniel (PI)
BRIQUET, Ludovic (Researcher)

Unit of theoretical and structural physico-chemistry
University of Namur

Project: PHD

Project Details

Description

The aim of this projec is to investigate, using quantum mechanics methods, the reaction mechanisms implied in the transition between the two stable configurations of two molecular switches constituted by a azobenzene/bipyridin unit complexed to a cyclodextrin.

Status	Finished
Effective start/end date	1/10/04 → 30/09/06

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Research Output

1 Article

Structural, Energetic, and Dynamical Properties of Rotaxanes Constituted of α-Cyclodextrins and an Azobenzene Chain

Briquet, L., Staelens, N., Leherte, L. & Vercauteren, D., 1 Jul 2007, In : Journal of Molecular Graphics and Modelling. 26, p. 104-116 13 p.

Research output: Contribution to journal › Article