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Page 1
Pseudopeptide foldamers: the homo-oligomers of pyroglutamic acid.
Bernardi F, Garavelli M, Scatizzi M, Tomasini C, Trigari V, Crisma M, Formaggio F, Peggion C, Toniolo C. Bernardi F, et al. Chemistry. 2002 Jun 3;8(11):2516-25. doi: 10.1002/1521-3765(20020603)8:11<2516::AID-CHEM2516>3.0.CO;2-K. Chemistry. 2002. PMID: 12180330
Intrinsically Competitive Photoinduced Polycyclization and Double-Bond Shift through a Boatlike Conical Intersection This work was supported by the Università di Siena (P.A.R. 99/00), the Università di Bologna (MURST ex-60 %), NATO (CRG 950748), and HFSP (RG 0229/2000-M).
Garavelli M, Bernardi F, Moliner V, Olivucci M. Garavelli M, et al. Among authors: bernardi f. Angew Chem Int Ed Engl. 2001 Apr 17;40(8):1466-1468. Angew Chem Int Ed Engl. 2001. PMID: 11317304 No abstract available.
A simple approach for improving the hybrid MMVB force field: application to the photoisomerization of s-cis butadiene.
Garavelli M, Ruggeri F, Ogliaro F, Bearpark MJ, Bernardi F, Olivucci M, Robb MA. Garavelli M, et al. Among authors: bernardi f. J Comput Chem. 2003 Aug;24(11):1357-63. doi: 10.1002/jcc.10278. J Comput Chem. 2003. PMID: 12827677
The method is demonstrated for the photoisomerization of s-cis butadiene, and we explain how the correction terms that enabled a successful MMVB dynamics study [Garavelli, M.; Bernardi, F.; Olivucci, M.; Bearpark, M. J.; Klein, S.; Robb, M. A. J Phys Chem A 2001, 10 …
The method is demonstrated for the photoisomerization of s-cis butadiene, and we explain how the correction terms that enabled a successful …
828 results