Entered: Wed Sep 14 2011

Operating systems: Linux; MacOS; MS Windows

Type: Binary; Source

Languages: C++

Distribution: Free

Application fields: Chemistry; Graphics; Structure; Structure determination; Visualization

Bibliography: C. B. Hübschle, G. M. Sheldrick & B. Dittrich (2011). J. Appl. Cryst. 44, 1281-1284.

Description: ShelXle is a graphical user interface (GUI) for SHELXL. It combines an editor with syntax highlighting feature and a OpenGL visualization of the structure including electron density maps. The GUI is written in C++ using the Qt4 library and the Fourier transformation for the map is done using FFTW3 library.



Last updated: 24 Mar 2017