Cargando...

PDB2PQR: an automated pipeline for the setup of Poisson–Boltzmann electrostatics calculations

Continuum solvation models, such as Poisson–Boltzmann and Generalized Born methods, have become increasingly popular tools for investigating the influence of electrostatics on biomolecular structure, energetics and dynamics. However, the use of such methods requires accurate and complete structural...

Descripción completa

Guardado en:
Detalles Bibliográficos
Autores principales: Dolinsky, Todd J., Nielsen, Jens E., McCammon, J. Andrew, Baker, Nathan A.
Formato: Artigo
Lenguaje:Inglês
Publicado: Oxford University Press 2004
Materias:
Acceso en línea:https://ncbi.nlm.nih.gov/pmc/articles/PMC441519/
https://ncbi.nlm.nih.gov/pubmed/15215472
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1093/nar/gkh381
Etiquetas: Agregar Etiqueta
Sin Etiquetas, Sea el primero en etiquetar este registro!