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Year | Number of Results |
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2005 | 1 |
2008 | 1 |
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Coarse-grained (multiscale) simulations in studies of biophysical and chemical systems.
Annu Rev Phys Chem. 2011;62:41-64. doi: 10.1146/annurev-physchem-032210-103335.
Annu Rev Phys Chem. 2011.
PMID: 21034218
Review.
A computational study of the hydrolysis of dGTP analogues with halomethylene-modified leaving groups in solution: implications for the mechanism of DNA polymerases.
Kamerlin SC, McKenna CE, Goodman MF, Warshel A.
Kamerlin SC, et al.
Biochemistry. 2009 Jun 30;48(25):5963-71. doi: 10.1021/bi900140c.
Biochemistry. 2009.
PMID: 19391628
Free PMC article.
Item in Clipboard
On possible pitfalls in ab initio quantum mechanics/molecular mechanics minimization approaches for studies of enzymatic reactions.
Klähn M, Braun-Sand S, Rosta E, Warshel A.
Klähn M, et al.
J Phys Chem B. 2005 Aug 18;109(32):15645-50. doi: 10.1021/jp0521757.
J Phys Chem B. 2005.
PMID: 16852982
Free PMC article.
Item in Clipboard
On the interpretation of the observed linear free energy relationship in phosphate hydrolysis: a thorough computational study of phosphate diester hydrolysis in solution.
Rosta E, Kamerlin SC, Warshel A.
Rosta E, et al.
Biochemistry. 2008 Mar 25;47(12):3725-35. doi: 10.1021/bi702106m. Epub 2008 Feb 29.
Biochemistry. 2008.
PMID: 18307312
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