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Experimental accuracy in protein structure refinement via molecular dynamics simulations

Refinement is the last step in protein structure prediction pipelines to convert approximate homology models to experimental accuracy. Protocols based on molecular dynamics (MD) simulations have shown promise, but current methods are limited to moderate levels of consistent refinement. To explore th...

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Bibliografiske detaljer
Udgivet i:Proc Natl Acad Sci U S A
Main Authors: Heo, Lim, Feig, Michael
Format: Artigo
Sprog:Inglês
Udgivet: National Academy of Sciences 2018
Fag:
Online adgang:https://ncbi.nlm.nih.gov/pmc/articles/PMC6310835/
https://ncbi.nlm.nih.gov/pubmed/30530696
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1073/pnas.1811364115
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