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B-DNA Under Stress: Over- and Untwisting of DNA during Molecular Dynamics Simulations

The twist flexibility of DNA is central to its many biological functions. Explicit solvent molecular dynamics simulations in combination with an umbrella sampling restraining potential have been employed to study induced twist deformations in DNA. Simulations allowed us to extract free energy profil...

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Bibliografiska uppgifter
Huvudupphovsmän: Kannan, Srinivasaraghavan, Kohlhoff, Kai, Zacharias, Martin
Materialtyp: Artigo
Språk:Inglês
Publicerad: Biophysical Society 2006
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Länkar:https://ncbi.nlm.nih.gov/pmc/articles/PMC1578486/
https://ncbi.nlm.nih.gov/pubmed/16861282
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1529/biophysj.106.087163
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