Conformational changes in nucleic acids play a key role in the way genetic information is
stored, transferred, and processed in living cells. Here, we describe new approaches that …

The modification of the ribofuranose in nucleic acids is a widespread method of
manipulating the activity of nucleic acids. These alterations, however, impact the local …

Recent studies have shown that RNAs exist in dynamic equilibrium with short-lived low-
abundance 'excited states' that form by reshuffling base pairs in and around non-canonical …

In this paper, we present the use of symbolic regression for the black-box modelling of non-
linear dynamic behaviour in the AC/DC rectifiers of radio-frequency identification (RFID) …

Structures of membrane proteins determined by X-ray crystallography and, increasingly, by
cryo-electron microscopy often fail to resolve the structural details of unstable or reactive …

The use of NMR-derived chemical shifts in protein structure determination and prediction
has received much attention, and, as such, many methods have been developed to predict …

NMR chemical shift predictions based on empirical methods are nowadays indispensable
tools during resonance assignment and 3D structure calculation of proteins. However, owing …

1 H, 13C and 15N NMR chemical shift calculations on RNAs were performed using the
automated fragmentation quantum mechanics/molecular mechanics (AF-QM/MM) approach …

DFT and MP2 calculations suggest that the intramolecular С‒Н··· N hydrogen bond between
the α-hydrogen of the vinyl group and pyridine nitrogen is formed in 2-vinyloxypyridine …

Determination of structure of RNA via NMR is complicated in large part by the lack of a
precise parameterization linking the observed chemical shifts to the underlying geometric …