Prediction of the 1H and 13C NMR Spectra of α-d-Glucose in Water by DFT Methods and MD Simulations
Alessandro Bagno, Federico Rastrelli, and Giacomo Saielli
J. Org. Chem., 2007, 72 (19), pp 7373–7381
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http://dx.doi.org/10.1021/jo071129v