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"DFT study and Monte Carlo simulation on proton transfers of ..."
Ying Xue et al. (2005)
- Ying Xue, Chan Kyung Kim, Yong Guo, Daiqian Xie, Guosen Yan:
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. J. Comput. Chem. 26(10): 994-1005 (2005)
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