Articles with "chirality distance" as a keyword



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Bayesian Inference Applied to NMR-Based Configurational Assignments by Floating Chirality Distance Geometry Calculations.

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Published in 2022 at "Journal of the American Chemical Society"

DOI: 10.1021/jacs.2c00813

Abstract: Using NMR data, the assignment of the correct 3D configuration and conformation to unknown natural products is of pivotal importance in pharmaceutical and medicinal chemistry. In this report, we quantify the quality and probability of… read more here.

Keywords: bayesian inference; floating chirality; geometry; chirality distance ... See more keywords