Experimental and Computational NMR Study of the Anticancer Drugs: Gemcitabine and Capecitabine

Nuclear magnetic resonance (NMR) parameters of anticancer drugs, Gemcitabine and Capecitabine, were measured experimentally and calculated at different computational levels of theory. The computed data were compared with the experimental ones. The least squares regression analyses of the results of Capcitabine (Gemcitabine) indicate R2 values greater than 0.997 (0.953) and 0.995 (0.988) for 1H and 13C data, respectively.

کلیدواژه ها:

Capecitabine ، Gemcitabine ، NMR ، cancer