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The G-triplex DNA.
Limongelli V, De Tito S, Cerofolini L, Fragai M, Pagano B, Trotta R, Cosconati S, Marinelli L, Novellino E, Bertini I, Randazzo A, Luchinat C, Parrinello M. Limongelli V, et al. Among authors: parrinello m. Angew Chem Int Ed Engl. 2013 Feb 18;52(8):2269-73. doi: 10.1002/anie.201206522. Epub 2013 Jan 17. Angew Chem Int Ed Engl. 2013. PMID: 23335456 No abstract available.
G-triplex structure and formation propensity.
Cerofolini L, Amato J, Giachetti A, Limongelli V, Novellino E, Parrinello M, Fragai M, Randazzo A, Luchinat C. Cerofolini L, et al. Among authors: parrinello m. Nucleic Acids Res. 2014 Dec 1;42(21):13393-404. doi: 10.1093/nar/gku1084. Epub 2014 Nov 6. Nucleic Acids Res. 2014. PMID: 25378342 Free PMC article.
Mechanistic insight into ligand binding to G-quadruplex DNA.
Di Leva FS, Novellino E, Cavalli A, Parrinello M, Limongelli V. Di Leva FS, et al. Among authors: parrinello m. Nucleic Acids Res. 2014 May;42(9):5447-55. doi: 10.1093/nar/gku247. Epub 2014 Apr 21. Nucleic Acids Res. 2014. PMID: 24753420 Free PMC article.
Funnel metadynamics as accurate binding free-energy method.
Limongelli V, Bonomi M, Parrinello M. Limongelli V, et al. Among authors: parrinello m. Proc Natl Acad Sci U S A. 2013 Apr 16;110(16):6358-63. doi: 10.1073/pnas.1303186110. Epub 2013 Apr 3. Proc Natl Acad Sci U S A. 2013. PMID: 23553839 Free PMC article.
395 results