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Protein hydration elucidated by molecular dynamics simulation.

Molecular dynamics (MD) simulation covering a wide range of hydration indicate that myoglobin is fully hydrated by 350 water molecules, in agreement with experiment. These waters, originally placed uniformly about the protein, form clusters that hydrate every charged group throughout the entire simu...

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Detalhes bibliográficos
Publicado no:Proc Natl Acad Sci U S A
Principais autores: Steinbach, P J, Brooks, B R
Formato: Artigo
Idioma:Inglês
Publicado em: National Academy of Sciences 1993
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.govhttps://pmc.ncbi.nlm.nih.gov/articles/PMC47516/
https://ncbi.nlm.nih.govhttps://pubmed.ncbi.nlm.nih.gov/8415667/
https://ncbi.nlm.nih.govhttps://doi.org/10.1073/pnas.90.19.9135
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