INVESTIGADORES
ENRIZ Ricardo Daniel
artículos
Título:
An ab initio exploratory study of side chain conformations for selected backbone conformations of N-acetyl-l-glutamine-N-methylamide
Autor/es:
A.TARDITTI; M.KLIPFEL; A.M.RODRIGUEZ; F.D.SUVIRE; G.CHASSE; O.FARKAS; A.PERCZEL; ENRIZ R.D.
Revista:
JOURNAL OF MOLECULAR STRUCTURE THEOCHEM
Editorial:
ELSEVIER SCIENCE BV
Referencias:
Lugar: Amsterdam; Año: 2001 vol. 545 p. 29 - 47
ISSN:
0166-1280
Resumen:
he backbone potential energy surface (PES) (Ramachandran map) of N-acetyl-l-glutamine-N-methylamide has been studied at a,a side-chain orientation. Side-chain PESs at selected backbone conformations (γl and βl) were also studied. Side-chain?backbone interactions were analyzed in terms of energy and geometry.
