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The rupture mechanism of rubredoxin is more complex than previously thought

The surprisingly low rupture force and remarkable mechanical anisotropy of rubredoxin have been known for several years. Exploiting the first combination of steered molecular dynamics and the quantum chemical Judgement of Energy DIstribution (JEDI) analysis, the common belief that hydrogen bonds bet...

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Detalles Bibliográficos
Autores principales:	Scheurer, Maximilian, Dreuw, Andreas, Head-Gordon, Martin, Stauch, Tim
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	The Royal Society of Chemistry 2020
Materias:	Chemistry
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8159389/ https://www.ncbi.nlm.nih.gov/pubmed/34094096 http://dx.doi.org/10.1039/d0sc02164d

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