PHENIX: building new software for automated crystallographic structure determination

Adams, P.D.; Grosse-Kunstleve, R.W.; Hung, L.-W.; Ioerger, T.R.; McCoy, A.J.; Moriarty, N.W.; Read, R.J.; Sacchettini, J.C.; Sauter, N.K.; Terwilliger, T.C.

doi:10.1107/S0907444902016657

Acta Crystallographica Section D
Acta Crystallographica
Section D BIOLOGICAL CRYSTALLOGRAPHY

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Figure 1
Architecture of the PHENIX system. The Python scripting language provides the backbone of the system. The Boost.Python library is used to integrate core C++ code into Python. On top of this, the data objects, crystallographic tasks, strategies and finally a graphical user interface are constructed. The Project Data Storage makes use of the pickle mechanism in Python to store data on the file system.

BIOLOGICAL
CRYSTALLOGRAPHY

ISSN: 1399-0047

Volume 58| Part 11| October 2002| Pages 1948-1954

doi:10.1107/S0907444902016657

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