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Exploring the molecular basis of the enantioselective binding of penicillin G acylase towards a series of 2-aryloxyalkanoic acids: a docking and molecular dynamics study.
Lavecchia A, Cosconati S, Novellino E, Calleri E, Temporini C, Massolini G, Carbonara G, Fracchiolla G, Loiodice F. Lavecchia A, et al. Among authors: novellino e. J Mol Graph Model. 2007 Mar;25(6):773-83. doi: 10.1016/j.jmgm.2006.07.001. Epub 2006 Aug 8. J Mol Graph Model. 2007. PMID: 16901739
Spiro[(dihydropyrazin-2,5-dione)-6,3'-(2',3'-dihydrothieno[2,3-b]naphtho-4',9'-dione)]-based cytotoxic agents: structure-activity relationship studies on the substituent at N4-position of the diketopiperazine domain.
Gomez-Monterrey I, Campiglia P, Carotenuto A, Stiuso P, Bertamino A, Sala M, Aquino C, Grieco P, Morello S, Pinto A, Ianelli P, Novellino E. Gomez-Monterrey I, et al. Among authors: novellino e. J Med Chem. 2008 May 22;51(10):2924-32. doi: 10.1021/jm7013056. Epub 2008 Apr 23. J Med Chem. 2008. PMID: 18429610
747 results