Cargando…
Structural and Energetic Analysis of 2-Aminobenzimidazole Inhibitors in Complex with the Hepatitis C Virus IRES RNA Using Molecular Dynamics Simulations
[Image: see text] Despite the many biological functions of RNA, very few drugs have been designed or found to target RNA. Here we report the results of molecular dynamics (MD) simulations and binding energy analyses on hepatitis C virus internal ribosome entry site (IRES) RNA in complex with highly...
Autores principales: | Henriksen, Niel M., Hayatshahi, Hamed S., Davis, Darrell R., Cheatham, Thomas E. |
---|---|
Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
American Chemical
Society
2014
|
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4076022/ https://www.ncbi.nlm.nih.gov/pubmed/24835734 http://dx.doi.org/10.1021/ci500132c |
Ejemplares similares
-
Molecular dynamics re-refinement of two different small RNA loop structures using the original NMR data suggest a common structure
por: Henriksen, Niel M., et al.
Publicado: (2012) -
Synthesis and Structure of Sulfur Derivatives from 2-Aminobenzimidazole
por: Cruz, Alejandro, et al.
Publicado: (2014) -
2-aminobenzimidazoles for leishmaniasis: From initial hit discovery to in vivo profiling
por: Ferreira, Rafael Augusto Alves, et al.
Publicado: (2021) -
Molecular Dynamics Simulations of the Dynamic and Energetic Properties of Alkali and Halide Ions Using Water-Model-Specific Ion Parameters
por: Joung, In Suk, et al.
Publicado: (2009) -
Structural and energetic properties of canonical and oxidized telomeric complexes studied by molecular dynamics simulations
por: Czeleń, Przemysław, et al.
Publicado: (2013)