[HTML][HTML] PHENIX: a comprehensive Python-based system for macromolecular structure solution

PD Adams, PV Afonine, G Bunkóczi… - … Section D: Biological …, 2010 - scripts.iucr.org
PD Adams, PV Afonine, G Bunkóczi, VB Chen, IW Davis, N Echols, JJ Headd, LW Hung
Acta Crystallographica Section D: Biological Crystallography, 2010scripts.iucr.org
Macromolecular X-ray crystallography is routinely applied to understand biological
processes at a molecular level. However, significant time and effort are still required to solve
and complete many of these structures because of the need for manual interpretation of
complex numerical data using many software packages and the repeated use of interactive
three-dimensional graphics. PHENIX has been developed to provide a comprehensive
system for macromolecular crystallographic structure solution with an emphasis on the …
Macromolecular X-ray crystallography is routinely applied to understand biological processes at a molecular level. However, significant time and effort are still required to solve and complete many of these structures because of the need for manual interpretation of complex numerical data using many software packages and the repeated use of interactive three-dimensional graphics. PHENIX has been developed to provide a comprehensive system for macromolecular crystallographic structure solution with an emphasis on the automation of all procedures. This has relied on the development of algorithms that minimize or eliminate subjective input, the development of algorithms that automate procedures that are traditionally performed by hand and, finally, the development of a framework that allows a tight integration between the algorithms.
International Union of Crystallography