WinGXandORTEP for Windows: an update
Publication type: Journal Article
Publication date: 2012-07-14
scimago Q1
wos Q1
SJR: 1.183
CiteScore: 8.5
Impact factor: 2.8
ISSN: 00218898, 16005767
General Biochemistry, Genetics and Molecular Biology
Abstract
TheWinGXsuite provides a complete set of programs for the treatment of small-molecule single-crystal diffraction data, from data reduction and processing, structure solution, model refinement and visualization, and metric analysis of molecular geometry and crystal packing, to final report preparation in the form of a CIF. It includes several well known pieces of software and provides a repository for programs when the original authors no longer wish to, or are unable to, maintain them. It also provides menu items to execute external software, such as theSIRandSHELXsuites of programs. The programORTEP for Windowsprovides a graphical user interface (GUI) for the classicORTEPprogram, which is the original software for the illustration of anisotropic displacement ellipsoids. The GUI code provides input capabilities for a wide variety of file formats, and extra functionality such as geometry calculations and ray-traced outputs. The programsWinGXandORTEP for Windowshave been distributed over the internet for about 15 years, and this article describes some of the more modern features of the programs.
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Farrugia L. J. WinGXandORTEP for Windows: an update // Journal of Applied Crystallography. 2012. Vol. 45. No. 4. pp. 849-854.
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Farrugia L. J. WinGXandORTEP for Windows: an update // Journal of Applied Crystallography. 2012. Vol. 45. No. 4. pp. 849-854.
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RIS
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TY - JOUR
DO - 10.1107/S0021889812029111
UR - https://doi.org/10.1107/S0021889812029111
TI - WinGXandORTEP for Windows: an update
T2 - Journal of Applied Crystallography
AU - Farrugia, Louis J.
PY - 2012
DA - 2012/07/14
PB - International Union of Crystallography (IUCr)
SP - 849-854
IS - 4
VL - 45
SN - 0021-8898
SN - 1600-5767
ER -
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BibTex (up to 50 authors)
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@article{2012_Farrugia,
author = {Louis J. Farrugia},
title = {WinGXandORTEP for Windows: an update},
journal = {Journal of Applied Crystallography},
year = {2012},
volume = {45},
publisher = {International Union of Crystallography (IUCr)},
month = {jul},
url = {https://doi.org/10.1107/S0021889812029111},
number = {4},
pages = {849--854},
doi = {10.1107/S0021889812029111}
}
Cite this
MLA
Copy
Farrugia, Louis J.. “WinGXandORTEP for Windows: an update.” Journal of Applied Crystallography, vol. 45, no. 4, Jul. 2012, pp. 849-854. https://doi.org/10.1107/S0021889812029111.