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CheSweet: An application to predict glycan's chemicals shifts
(Journal of Open Source Software, 2018-01)
The knowledge of the tridimensional structure of glycans is necessary to understand in detail, at atomic level, the molecular processes in which they are involved. Chemical Shifts (CS) are observables obtained from Nuclear ...
Classification of RNA backbone conformations into rotamers using 13C' chemical shifts: Exploring how far we can go
(PeerJ Inc., 2019-10)
The conformational space of the ribose-phosphate backbone is very complex as it is defined in terms of six torsional angles. To help delimit the RNA backbone conformational preferences, 46 rotamers have been defined in ...
Why downfield proton chemical shifts are not reliable aromaticity indicators
(American Chemical Society, 2005-12)
(Chemical Equation Presented) Traces of magnetizability, traces of magnetic shielding at the hydrogen nuclei, and nucleus-independent chemical shift are not reliable aromaticity quantifiers for planar conjugated hydrocarbons. ...
Bias dependent response reversal in chemically sensitive metal oxide semiconductor capacitors
(American Institute of Physics, 2008-12)
Conditions for reversal of the voltage shift in chemically sensitive metal oxide semiconductor capacitors are surveyed with the pulsed illumination technique in SiSi O2 Me0 capacitors, with annular Pd and Au gates under ...