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Default Probabilistic Modeling of RNA Ensembles Using NMR Chemical Shifts

Probabilistic Modeling of RNA Ensembles Using NMR Chemical Shifts

NMR-derived chemical shifts are structural fingerprints that are sensitive to the underlying conformational distributions of molecules. Thus, chemical shift data are now routinely used to infer the dynamical or conformational ensembles of peptides and proteins. However, for RNAs, techniques for inferring their conformational ensembles from chemical shift data have received less attention. Here, we used chemical shift data and the Bayesian/maximum entropy (BME) approach to model the secondary...

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