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Research Output 1987 2019

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Catalog chapter contribution
Catalog chapter contribution

Application of multiresolution analyses to electron density maps: A critical point analysis approach for the comparison of molecules

Leherte, L., Meurice, N. & Vercauteren, D., 1 Jan 2000, Mathematics and Computers in Modern Science - Acoustics and Music, Biology and Chemistry, Business and Economics. Mastorakis, N. (ed.). p. 158-164 7 p.

Research output: Contribution in Book/Catalog/Report/Conference proceedingCatalog chapter contribution

critical point
simulated annealing
smoothing
molecules
diffraction

Quantum Mechanical and ReaxFF-Based Studies of the Intramolecular Investigations on the Iminium-Enamine Conversion in a Proline Catalyzed Reaction

Hubin, P., Jacquemin, D., Leherte, L. & Vercauteren, D. P., 2012, Abstracts of Papers of the American Chemical Society. Vol. 243. p. COMP-259

Research output: Contribution in Book/Catalog/Report/Conference proceedingCatalog chapter contribution