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Results: 1-4 |
Results: 4
Hydride shift in substituted phenyl glyoxals: Interpretation of experimental rate data using electronic structure and variational transition state theory calculations
Authors: Tresadern, G Willis, J Hillier, IH Watt, CIF
Citation: G. Tresadern et al., Hydride shift in substituted phenyl glyoxals: Interpretation of experimental rate data using electronic structure and variational transition state theory calculations, PHYS CHEM P, 3(18), 2001, pp. 3967-3972
QM/MM studies show substantial tunneling for the hydrogen-transfer reaction in methylamine dehydrogenase
Authors: Faulder, PF Tresadern, G Chohan, KK Scrutton, NS Sutcliffe, MJ Hillier, IH Burton, NA
Citation: Pf. Faulder et al., QM/MM studies show substantial tunneling for the hydrogen-transfer reaction in methylamine dehydrogenase, J AM CHEM S, 123(35), 2001, pp. 8604-8605
Exploration of the mechanism of the activation of ClONO2 by HCl in small water clusters using electronic structure methods
Authors: McNamara, JP Tresadern, G Hillier, IH
Citation: Jp. Mcnamara et al., Exploration of the mechanism of the activation of ClONO2 by HCl in small water clusters using electronic structure methods, J PHYS CH A, 104(17), 2000, pp. 4030-4044
The facile decomposition of chlorine nitrate in small water clusters
Authors: McNamara, JP Tresadern, G Hillier, IH
Citation: Jp. Mcnamara et al., The facile decomposition of chlorine nitrate in small water clusters, CHEM P LETT, 310(3-4), 1999, pp. 265-270
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