Significant reduction in errors associated with nonbonded contacts in protein crystal structures: automated all-atom refinement with PrimeX

All-atom models are essential for many applications in molecular modeling and computational chemistry. Non­bonded atomic contacts much closer than the sum of the van der Waals radii of the two atoms (clashes) are commonly observed in such models derived from protein crystal structures. A set of 94 r...

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Detalles Bibliográficos
Autores principales: Bell, Jeffrey A., Ho, Kenneth L., Farid, Ramy
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2012
Materias:
Research Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3413210/
https://www.ncbi.nlm.nih.gov/pubmed/22868759
http://dx.doi.org/10.1107/S0907444912017453

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3413210/
https://www.ncbi.nlm.nih.gov/pubmed/22868759
http://dx.doi.org/10.1107/S0907444912017453

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