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Ranking of Molecular Biomarker Interaction with Targeted DNA Nucleobases via Full Atomistic Molecular Dynamics

DNA-based sensors can detect disease biomarkers, including acetone and ethanol for diabetes and H(2)S for cardiovascular diseases. Before experimenting on thousands of potential DNA segments, we conduct full atomistic steered molecular dynamics (SMD) simulations to screen the interactions between di...

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Detalles Bibliográficos
Autores principales:	Zhang, Wenjun, Wang, Ming L., Cranford, Steven W.
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	Nature Publishing Group 2016
Materias:	Article
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4707552/ https://www.ncbi.nlm.nih.gov/pubmed/26750747 http://dx.doi.org/10.1038/srep18659

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