Recent developments in the PHENIX software for automated crystallographic structure determination

被引：317

作者：

Adams, PD

Gopal, K

Grosse-Kunstleve, RW

Hung, LW

Ioerger, TR

McCoy, AJ

Moriarty, NW

Pai, RK

Read, RJ

Romo, TD

Sacchettin, JC

Sauter, NK

Storoni, LC

Terwilligerf, TC

机构：

[1] Univ Calif Berkeley, Lawrence Berkeley Lab, Berkeley, CA 94720 USA

[2] Texas A&M Univ, Dept Comp Sci, College Stn, TX 77843 USA

[3] Los Alamos Natl Lab, Biophys Grp, Los Alamos, NM 87545 USA

[4] Univ Cambridge, Dept Haematol, Cambridge Inst Med Res, Cambridge CB2 2XY, England

[5] Texas A&M Univ, Dept Biochem & Biophys, College Stn, TX 77843 USA

来源：

JOURNAL OF SYNCHROTRON RADIATION | 2004年 / 11卷

关键词：

PHENIX; !text type='Python']Python[!/text; object-oriented programming; strategies;

D O I：

10.1107/S0909049503024130

中图分类号：

TH7 [仪器、仪表];

学科分类号：

0804 ; 080401 ; 081102 ;

摘要：

A new software system called PHENIX (Python-based Hierarchical ENvironment for Integrated Xtallography) is being developed for the automation of crystallographic structure solution. This will provide the necessary algorithms to proceed from reduced intensity data to a refined molecular model, and facilitate structure solution for both the novice and expert crystallographer. Here we review the features of PHENIX and briefly describe the recent advances in infrastructure and algorithms.

引用

页码：53 / 55

页数：3

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