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Scripts and interfaces (view source)
Revision as of 13:39, 10 September 2014
, 13:39, 10 September 2014update
== XDSi ==
== XDSi ==
the first published interface, by Petri Kursula (XDSi: a graphical interface for the data processing program XDS. (2004) J. Appl. Cryst. 37, 347-348). http://cc.oulu.fi/~pkursula/xdsi.html gives 2007 as last modification date.
the first published interface, by Petri Kursula (XDSi: a graphical interface for the data processing program XDS. (2004) J. Appl. Cryst. 37, 347-348).
http://cc.oulu.fi/~pkursula/xdsi.html gives 2007 as last modification date.
== [[XDSi]] ==
== [[XDSi]] ==
Tcl/Tk interface by Michael Krug (Welte/Diederichs lab). Unfortunately same name. Can process multiple datasets.
Tcl/Tk interface by Michael Krug (Welte/Diederichs lab). Unfortunately same name. Can process multiple datasets.
== XDSAPP ==
python/Qt version of [[XDSi]], developed at [http://www.helmholtz-berlin.de/forschung/oe/em/soft-matter/forschung/bessy-mx/xdsapp/index_en.html BESSY].
== [[XDSGUI]] ==
to edit input files and run commands.
== ixds ==
== ixds ==
== autoxds ==
== autoxds ==
script in use at SSRL (Stanford) . See [A Quick XDS Tutorial for SSRL http://smb.slac.stanford.edu/facilities/software/xds/]. Download: http://smb.slac.stanford.edu/templates/xds/autoxds ; download http://smb.slac.stanford.edu/templates/xds/mccd_xdsparams.pl , too!
script in use at SSRL (Stanford) . See [http://smb.slac.stanford.edu/facilities/software/xds/ A Quick XDS Tutorial for SSRL].
Download: http://smb.slac.stanford.edu/templates/xds/autoxds ; download http://smb.slac.stanford.edu/templates/xds/mccd_xdsparams.pl , too!
== autoPROC ==
software package, not exclusively using XDS, available at http://www.globalphasing.com/autoproc/ (Vonrhein ''et al.'' (2011). Acta Cryst. D67, 293-302)
== AutoProcess ==
== AutoProcess ==
* XOalign.py for the goniometer setting calculation (to work with different type of goniometer including Kappa, mini-Kappa, Euler...).
* XOalign.py for the goniometer setting calculation (to work with different type of goniometer including Kappa, mini-Kappa, Euler...).
* xds2mos.py or xds2dnz.py ... (for conversion of orientation matrices)
* xds2mos.py or xds2dnz.py ... (for conversion of orientation matrices)
== [[generate_XDS.INP]] ==
== [[generate_XDS.INP]] ==
is a script for generating a XDS.INP for a given dataset. Under development; works well for MarCCD, ADSC and Pilatus detectors.
is a script for generating a XDS.INP for a given dataset. Under development; works well for MarCCD, ADSC and Pilatus detectors.