Ergodicity and model quality in template-restrained canonical and temperature/Hamiltonian replica exchange coarse-grained molecular dynamics simulations of proteins

Ergodicity and model quality in template-restrained canonical and temperature/Hamiltonian replica exchange coarse-grained molecular dynamics simulations of proteins

© 2017 Wiley Periodicals, Inc.

Bibliographische Detailangaben
Veröffentlicht in:Journal of computational chemistry. - 1984. - 38(2017), 31 vom: 05. Dez., Seite 2730-2746
1. Verfasser: Karczyńska, Agnieszka S (VerfasserIn)
Weitere Verfasser: Czaplewski, Cezary, Krupa, Paweł, Mozolewska, Magdalena A, Joo, Keehyoung, Lee, Jooyoung, Liwo, Adam
Format: Online-Aufsatz
Sprache:English
Veröffentlicht: 2017
Zugriff auf das übergeordnete Werk:Journal of computational chemistry
Schlagworte:Journal Article Research Support, Non-U.S. Gov't UNRES force field ergodicity multiplexed replica exchange molecular dynamics protein-structure prediction template-based modeling Proteins
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