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- 2016
-
Mark
Probing the mechanisms for the selectivity and promiscuity of methyl parathion hydrolase
Purg, Miha ; Pabis, Anna ; Baier, Florian ; Tokuriki, Nobuhiko ; Jackson, Colin and Kamerlin, Shina Caroline Lynn LU
(2016)
In Philosophical Transactions of the Royal Society A: Mathematical, Physical and Engineering Science
374(2080).
- Contribution to journal › Article
- 2014
-
Mark
Force field independent metal parameters using a nonbonded dummy model
Duarte, Fernanda ; Bauer, Paul ; Barrozo, Alexandre ; Amrein, Beat Anton ; Purg, Miha ; Åqvist, Johan and Kamerlin, Shina Caroline Lynn LU
(2014)
In The Journal of Physical Chemistry Part B
118(16).
p.62-4351
- Contribution to journal › Article
- 2009
-
Mark
The M17 leucine aminopeptidase of the malaria parasite Plasmodium falciparum : importance of active site metal ions in the binding of substrates and inhibitors
- Contribution to journal › Article
- 2007
-
Mark
The role of metal ions in phosphate ester hydrolysis
Kamerlin, Shina C L LU
and Wilkie, John
(2007)
In Organic and Biomolecular Chemistry
5(13).
p.108-2098
- Contribution to journal › Article