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Antibacterial drug leads targeting isoprenoid biosynthesis.
Zhu W, Zhang Y, Sinko W, Hensler ME, Olson J, Molohon KJ, Lindert S, Cao R, Li K, Wang K, Wang Y, Liu YL, Sankovsky A, de Oliveira CA, Mitchell DA, Nizet V, McCammon JA, Oldfield E. Zhu W, et al. Among authors: de oliveira ca. Proc Natl Acad Sci U S A. 2013 Jan 2;110(1):123-8. doi: 10.1073/pnas.1219899110. Epub 2012 Dec 17. Proc Natl Acad Sci U S A. 2013. PMID: 23248302 Free PMC article.
Population based reweighting of scaled molecular dynamics.
Sinko W, Miao Y, de Oliveira CA, McCammon JA. Sinko W, et al. Among authors: de oliveira ca. J Phys Chem B. 2013 Oct 24;117(42):12759-68. doi: 10.1021/jp401587e. Epub 2013 Jul 11. J Phys Chem B. 2013. PMID: 23721224 Free PMC article.
POVME: an algorithm for measuring binding-pocket volumes.
Durrant JD, de Oliveira CA, McCammon JA. Durrant JD, et al. Among authors: de oliveira ca. J Mol Graph Model. 2011 Feb;29(5):773-6. doi: 10.1016/j.jmgm.2010.10.007. Epub 2010 Nov 3. J Mol Graph Model. 2011. PMID: 21147010 Free PMC article.
275 results