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Metadynamic metainference: Enhanced sampling of the metainference ensemble using metadynamics

Accurate and precise structural ensembles of proteins and macromolecular complexes can be obtained with metainference, a recently proposed Bayesian inference method that integrates experimental information with prior knowledge and deals with all sources of errors in the data as well as with sample h...

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Bibliografski detalji
Izdano u:Sci Rep
Glavni autori: Bonomi, Massimiliano, Camilloni, Carlo, Vendruscolo, Michele
Format: Artigo
Jezik:Inglês
Izdano: Nature Publishing Group 2016
Teme:
Online pristup:https://ncbi.nlm.nih.gov/pmc/articles/PMC4999896/
https://ncbi.nlm.nih.gov/pubmed/27561930
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1038/srep31232
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