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Molecular dynamics simulations of a polyelectrolyte star in poor solvent

✍ Scribed by Košovan, Peter; Kuldová, Jitka; Limpouchová, Zuzana; Procházka, Karel; Zhulina, Ekaterina B.; Borisov, Oleg V.


Book ID
121403911
Publisher
Royal Society of Chemistry
Year
2010
Tongue
English
Weight
262 KB
Volume
6
Category
Article
ISSN
1744-683X

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## Abstract A mixed Monte Carlo/Molecular Dynamics method using the trial moves for peptide backbone sampling known as Concerted Rotations with Angles was implemented. The algorithm was used to study polyalanine systems. Equivalent results to conventional Molecular Dynamics were obtained for simula