The conformation of a Cyclolinopeptide A analogue has been investigated by means of molecular dynamic (MD) simulation in various environments. The MD results are compared with that obtained for Cyclolinopetide A and a detailed analysis of the different compounds is reported. In addition a complete analysis of H bond is reported.
Molecular Dynamic simulation in vacuo and in solution of [aib5,6-D-Ala8]Cyclolinopeptide A: a conformational and comparative study / Saviano, M.; Rossi, Filomena; Pavone, Vincenzo; Di Blasio, B.; Pedone, C.. - In: JOURNAL OF BIOMOLECULAR STRUCTURE & DYNAMICS. - ISSN 0739-1102. - STAMPA. - 9:6(1992), pp. 1045-1060.
Molecular Dynamic simulation in vacuo and in solution of [aib5,6-D-Ala8]Cyclolinopeptide A: a conformational and comparative study
ROSSI, FILOMENA;PAVONE, VINCENZO;
1992
Abstract
The conformation of a Cyclolinopeptide A analogue has been investigated by means of molecular dynamic (MD) simulation in various environments. The MD results are compared with that obtained for Cyclolinopetide A and a detailed analysis of the different compounds is reported. In addition a complete analysis of H bond is reported.I documenti in IRIS sono protetti da copyright e tutti i diritti sono riservati, salvo diversa indicazione.
