검색결과 : 5건
| No. | Article |
|---|---|
| 1 |
High Level QM/MM Modeling of the Formation of the Tetrahedral Intermediate in the Acylation of Wild Type and K73A Mutant TEM-1 Class A beta-Lactamase Hermann JC, Pradon J, Harvey JN, Mulholland AJ Journal of Physical Chemistry A, 113(43), 11984, 2009 |
| 2 |
Predicting substrates by docking high-energy intermediates to enzyme structures Hermann JC, Ghanem E, Li YC, Raushel FM, Irwin JJ, Shoichet BK Journal of the American Chemical Society, 128(49), 15882, 2006 |
| 3 |
Resolution of chiral phosphate, phosphonate, and phosphinate esters by an enantioselective enzyme library Nowlan C, Li YC, Hermann JC, Evans T, Carpenter J, Ghanem E, Shoichet BK, Raushel FM Journal of the American Chemical Society, 128(49), 15892, 2006 |
| 4 |
Mechanisms of antibiotic resistance: QM/MM modeling of the acylation reaction of a class A beta-lactamase with benzylpenicillin Hermann JC, Hensen C, Ridder L, Mulholland AJ, Holtje HD Journal of the American Chemical Society, 127(12), 4454, 2005 |
| 5 |
Identification of Glu166 as the general base in the acylation reaction of class A beta-lactamases through QM/MM modeling Hermann JC, Ridder L, Mulholland AJ, Holtje HD Journal of the American Chemical Society, 125(32), 9590, 2003 |