Extension of the AMBER force field to cyclic α,α dialkylated peptides.
Grubišić S, Brancato G, Pedone A, Barone V.
Grubišić S, et al. Among authors: pedone a.
Phys Chem Chem Phys. 2012 Nov 28;14(44):15308-20. doi: 10.1039/c2cp42713c. Epub 2012 Oct 10.
Phys Chem Chem Phys. 2012.
PMID: 23051698
Together with the recent set of nitroxide parameters [E. Stendardo, A. Pedone, P. Cimino, M. C. Menziani, O. Crescenzi and V. Barone, Phys. ...In particular, we found that the 3(10) helical structure of heptapeptide is the most stable one in vacuo, with a geo …
Together with the recent set of nitroxide parameters [E. Stendardo, A. Pedone, P. Cimino, M. C. Menziani, O. Crescenzi and V. …