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Media type:
E-Article
Title:
Exploring the conformational preferences of 20-residue peptides in isolation: Ac-Ala19-Lys + H+vs. Ac-Lys-Ala19 + H+ and the current reach of DFT
Published in:
Physical Chemistry Chemical Physics, 17 (2015) 11, Seite 7373-7385
Language:
English
DOI:
10.1039/c4cp05541a
ISSN:
1463-9076;
1463-9084
Origination:
Footnote:
Description:
Using a high-level density functional and an exhaustive search of conformation space, the predicted conformation of a 20-amino acid peptide explains two seemingly contradictory experiments.