XDSGUI: Difference between revisions

89 bytes added ,  1 December 2020
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=== Dependencies ===
=== Dependencies ===


XDSGUI depends on [[generate_XDS.INP]], [[XDS-viewer]], and of course [[XDS]] (both the xds and xds_par binaries!), [[XDSCONV]], and [[2cbf]]. The ''statistics'' tab requires [[XDSSTAT]] and [[XDSCC12]]. As discussed in [[Generate_XDS.INP#Dependencies]], [[Eiger]] data processing requires the <code>h5dump</code> binary, and either the <code>H5ToXds</code> binary or the <code>dectris-neggia</code> library (available from Dectris) or the <code>durin-plugin</code> library (download from Diamond Light Source, DLS). The library should be put into a directory (e.g. /usr/local/lib64), and the full path to it (e.g. /usr/local/lib64/dectris-neggia.so) should be entered into the "generic frame library" entry, in Menu->Settings.  
XDSGUI depends on [[generate_XDS.INP]], [[XDS-viewer]], and of course [[XDS]] (both the xds and xds_par binaries!), [[XDSCONV]], and [[2cbf]]. The ''statistics'' tab requires [[XDSSTAT]] and [[XDSCC12]]. For visualization of the raw data frames in the ''Frame'' tab, [[Eiger]] data processing requires either the [https://www.dectris.com/features/features-eiger-x/h5toxds/ <code>H5ToXds</code>] binary or the [https://www.globalphasing.com/autoproc/wiki/index.cgi?DataProcessingHdf5 <code>hdf2mini-cbf</code>] binary (needs autoPROC license) or the [https://github.com/biochem-fan/eiger2cbf <code>eiger2cbf</code>] binary. Only the latter two work for the .h5 files produced at Diamond Light Source; if these should be used, they need to be symlinked under the name H5ToXds (because XDSGUI has the name H5ToXds hardwired).


One of the items in the <code>tools</code> tab calls a graphical file comparison program; if the default (xdiff) is not available, [http://furius.ca/xxdiff xxdiff] or [http://sourceforge.net/projects/tkdiff tkdiff] or [http://kdiff3.sourceforge.net/ kdiff3] or [http://meldmerge.org/ meld] may be used - please adjust the command line (below the button) accordingly.  
One of the items in the ''tools'' tab calls a graphical file comparison program; if the default (xdiff) is not available, [http://furius.ca/xxdiff xxdiff] or [http://sourceforge.net/projects/tkdiff tkdiff] or [http://kdiff3.sourceforge.net/ kdiff3] or [http://meldmerge.org/ meld] may be used - please adjust the command line (below the button) accordingly.  


The XDSCONV functionality requires a working CCP4 installation for conversion to MTZ files. Likewise, XDSSTAT (in the statistics tab) needs CCP4.
The XDSCONV functionality requires a working CCP4 installation for conversion to MTZ files. Likewise, XDSSTAT (in the ''statistics'' tab) needs CCP4.


Technically, the word "dependency" means that these scripts/programs should be in your $PATH - an 'alias' is often not good enough because the ''TOOLS'' commands use <code>bash</code> as a shell, and that shell does not inherit the aliases from e.g. (t)csh.
Technically, the word "dependency" means that these scripts/programs should be in your $PATH - an 'alias' is often not good enough because the ''TOOLS'' commands use <code>bash</code> as a shell, and that shell does not inherit the aliases from e.g. (t)csh.
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