Simple and efficient program for predicting non-exchangeable 1H and protonated 13C RNA chemical shifts
LARMORD predicts chemical shifts using a polynomial expansion of distances between the nucleus of interest and all heavy atoms with a bimolecule. Currently, LARMORD predicts chemical shifts of non-exchangeable 1H and protonated 13C nuclei in RNA. It can also predict imino 1H and 15N, however, because of the paucity of imino chemical shifts in the training database, and uncertainties about the referencing of imino 15N, these predictors should be considered experimental and tentative.
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