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Protein Structure Refinement via Molecular-Dynamics Simulations: What works and what does not?

Protein structure refinement during CASP11 by the Feig group is described. Molecular dynamics simulations were used in combination with an improved selection and averaging protocol. On average, modest refinement was achieved with some targets improved significantly. Analysis of the CASP submission f...

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Publicat a:Proteins
Autors principals: Feig, Michael, Mirjalili, Vahid
Format: Artigo
Idioma:Inglês
Publicat: 2015
Matèries:
Accés en línia:https://ncbi.nlm.nih.gov/pmc/articles/PMC5493977/
https://ncbi.nlm.nih.gov/pubmed/26234208
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1002/prot.24871
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