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“Infostery” analysis of short molecular dynamics simulations identifies highly sensitive residues and predicts deleterious mutations

Characterizing a protein mutational landscape is a very challenging problem in Biology. Many disease-associated mutations do not seem to produce any effect on the global shape nor motions of the protein. Here, we use relatively short all-atom biomolecular simulations to predict mutational outcomes a...

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Detalhes bibliográficos
Publicado no:Sci Rep
Main Authors: Karami, Yasaman, Bitard-Feildel, Tristan, Laine, Elodie, Carbone, Alessandra
Formato: Artigo
Idioma:Inglês
Publicado em: Nature Publishing Group UK 2018
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC6208415/
https://ncbi.nlm.nih.gov/pubmed/30382169
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1038/s41598-018-34508-2
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