Quantitative Conformational Analysis of Dissymmetric Macrolides by Molecular Modelling
Corresponding Author(s) : S. Belaidi
salah_belaidi@hotmail.com
Asian Journal of Chemistry,
Vol. 17 No. 2 (2005): Vol 17 Issue 2
Abstract
Conformational analysis of dissymmetric macrolides was carried out using molecular modelling (molecular mechanics and molecular dynamics). Calculations indicate that each macrocycle presents eight families of preferential conformers. An important stereoselectivity of the complexed macrocycles was obtained. The Boltzmann distribution of the starting conformations can be used to predict the stereoselectivity of these reactions.
Keywords
Macrolide
Molecular mechanics
Molecular dynamics
Conformational analysis
Stereoselectivity
Belaidi, S., Lanez, T., Omari, M., & Botrel, A. (2016). Quantitative Conformational Analysis of Dissymmetric Macrolides by Molecular Modelling. Asian Journal of Chemistry, 17(2), 859–870. Retrieved from https://asianpubs.org/index.php/ajchem/article/view/14281
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