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Improved Model of Hydrated Calcium Ion for Molecular Dynamics Simulations Using Classical Biomolecular Force Fields

Calcium ions (Ca(2+)) play key roles in various fundamental biological processes such as cell signaling and brain function. Molecular dynamics (MD) simulations have been used to study such interactions, however, the accuracy of the Ca(2+) models provided by the standard MD force fields has not been...

Disgrifiad llawn

Wedi'i Gadw mewn:
Manylion Llyfryddiaeth
Cyhoeddwyd yn:Biopolymers
Prif Awduron: Yoo, Jejoong, Wilson, James, Aksimentiev, Aleksei
Fformat: Artigo
Iaith:Inglês
Cyhoeddwyd: 2016
Pynciau:
Mynediad Ar-lein:https://ncbi.nlm.nih.gov/pmc/articles/PMC4958550/
https://ncbi.nlm.nih.gov/pubmed/27144470
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1002/bip.22868
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