XDSAPP
XDSAPP is a graphical user interface for the processing of diffraction data sets using XDS. It automates the data hadling and generates graphical plots of various data set statistics provided by XDS and other programs. By incorporating additional software, further information on certain features of the data set, such as radiation decay or the presence of pseudo-translational symmetry and/or twinning is provided. Intensity files suitable for CCP4, SHELX and CNS are automatically generated.
| Website | https://www.helmholtz-berlin.de/forschung/oe/em/soft-matter/forschung/bessy-mx/xdsapp/index_en.html |
| Licenses | Other (Open) |
| Categories | Data analysis Crystallography Macromolecular Crystallography |
| Software Requirements | Needs XDS, Qt4, Qwt5; Strongly recommended: XDSSTAT CCP4 suite (especially POINTLESS, SFCHECK, CAD, F2MTZ) PHENIX.XTRIAGE |
| Hardware Requirements | - | Platforms | Mac OS Linux |
| Languages | Python |
| Input Formats | There are no input formats associated to this software. |
| Output Formats | There are no output formats associated to this software. |
| Contact email | xdsapp@helmholtz-berlin.de |
| How-to | |
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Installed on the central (rnice) cluster, runnable via: |
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| Documentation / Tutorials | |
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Readme file on rnice: /sware/exp/pxsoft/XDSAPP/vdefault/linux-x86_64/readme |
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| References | |
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M. Krug, M.S. Weiss, U. Mueller, U. Heinemann (2012), J. Appl. Cryst. 45, 568-572 Kabsch W. (2010). Acta Cryst. D66, 125-132. Adams P. D., Afonine P. V., Bunkoczi G., Chen V. B., Davis I. W., Echols N., Headd J. J., Hung L.-W., Kapral G. J., Grosse-Kunstleve R. W., McCoy A. J., Moriarty N. W., Oeffner R., Read R. J., Richardson D. C., Richardson J. S., Terwilliger T. C. & Zwart P. H. (2010). Acta Cryst. D66, 213-221. |
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| Instruments | ID23-1 (ESRF) ID23-2 (ESRF) ID29 (ESRF) ID30A-1 (ESRF) ID30A-3 (ESRF) ID30A-2 (ESRF) ID30B (ESRF) |
