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Overview of the CCP4 suite and current developments

The CCP4 (Collaborative Computational Project, Number 4) software suite is a collection of programs and associated data and software libraries which can be used for macromolecular structure determination by X-ray crystallography. The suite is designed to be flexible, allowing users a number of metho...

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Detalles Bibliográficos
Autores principales: Winn, Martyn D., Ballard, Charles C., Cowtan, Kevin D., Dodson, Eleanor J., Emsley, Paul, Evans, Phil R., Keegan, Ronan M., Krissinel, Eugene B., Leslie, Andrew G. W., McCoy, Airlie, McNicholas, Stuart J., Murshudov, Garib N., Pannu, Navraj S., Potterton, Elizabeth A., Powell, Harold R., Read, Randy J., Vagin, Alexei, Wilson, Keith S.
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2011
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3069738/
https://www.ncbi.nlm.nih.gov/pubmed/21460441
http://dx.doi.org/10.1107/S0907444910045749
Descripción
Sumario:The CCP4 (Collaborative Computational Project, Number 4) software suite is a collection of programs and associated data and software libraries which can be used for macromolecular structure determination by X-ray crystallography. The suite is designed to be flexible, allowing users a number of methods of achieving their aims. The programs are from a wide variety of sources but are connected by a common infrastructure provided by standard file formats, data objects and graphical interfaces. Structure solution by macromolecular crystallo­graphy is becoming increasingly automated and the CCP4 suite includes several automation pipelines. After giving a brief description of the evolution of CCP4 over the last 30 years, an overview of the current suite is given. While detailed descriptions are given in the accompanying articles, here it is shown how the individual programs contribute to a complete software package.