Theoretical study on the hydrolysis mechanism of N,N-dimethyl-N'-(2-oxo-1, 2-dihydro-pyrimidinyl)formamidine water-assisted mechanism and cluster-continuum model

von Wu, Yong
Veröffentlicht in: Journal of computational chemistry (2008)

DFT study and Monte Carlo simulation on proton transfers of 2-amino-2-oxazoline, 2-amino-2-thiazoline, and 2-amino-2-imidazoline in the gas phase and in water

von Xue, Ying
Veröffentlicht in: Journal of computational chemistry (2005)