Dear CCP4BB users, we would hereby like to introduce XDSAPP, a GUI for the easy and convenient processing of diffraction data sets using XDS (see also Krug et al. (2012). J. Appl. Cryst. 45, 568-572).
XDSAPP automates the data processing, generates plots of various data set statistics and produces intensity files suitable for further analysis using CCP4, SHELX and CNS. XDSAPP has the following features: - detector support for Rayonics MX-225, MARCCD-165 mm, PILATUS 6M and ADSC Quantum Q315r - Successfully tested on various Linux platforms - Full XDS-multiprocessor support - Space group determination using pointless - Twinning and pseudo-translation analysis using phenix.xtriage and sfcheck (CCP4 and PHENIX programs must be installed separately) - Life graphics during Integration - Graphical output of statistics of CORRECT and XDSSTAT (XDSSTAT must be installed separately) - All XDS output files (.pck, .cbf, .LP) available for viewing within the GUI - Automatic multi-crystal processing - Output files in mtz, hkl and cv format XDSAPP is freely available for academics. More information on XDSAPP including download instructions can be found at: http://www.helmholtz-berlin.de/bessy-mx Uwe Mueller, Manfred S. Weiss and Michael Krug Dr. Uwe Mueller Soft Matter and Functional Materials Macromolecular Crystallography (BESSY-MX) | Group leader Elektronenspeicherring BESSY II Albert-Einstein-Str. 15, D-12489 Berlin, Germany Fon: +49 30 8062 14974 Fax: +49 30 8062 14975 url: www.helmholtz-berlin.de/bessy-mx<http://www.helmholtz-berlin.de/bessy-mx> email:u...@helmholtz-berlin.de<mailto:u...@helmholtz-berlin.de> ________________________________ Helmholtz-Zentrum Berlin für Materialien und Energie GmbH Mitglied der Hermann von Helmholtz-Gemeinschaft Deutscher Forschungszentren e.V. Aufsichtsrat: Vorsitzender Prof. Dr. Dr. h.c. mult. Joachim Treusch, stv. Vorsitzende Dr. Beatrix Vierkorn-Rudolph Geschäftsführung: Prof. Dr. Anke Rita Kaysser-Pyzalla, Thomas Frederking Sitz Berlin, AG Charlottenburg, 89 HRB 5583 Postadresse: Hahn-Meitner-Platz 1 D-14109 Berlin http://www.helmholtz-berlin.de
