2,684
edits
Line 205: | Line 205: | ||
export DISPLAY=:0 | export DISPLAY=:0 | ||
XDSGUI requires | XDSGUI requires | ||
sudo apt-get install | sudo apt-get install libgomp1 libqtgui4 | ||
and [[generate_XDS.INP]] requires a number of packages (some of which only for specific detectors!); I'd start with | and [[generate_XDS.INP]] requires a number of packages (some of which are only for specific detectors!); I'd start with | ||
sudo apt-get install coreutils binutils gawk sed bc grep | sudo apt-get install coreutils binutils gawk sed bc grep | ||
and if required, also install python and hdf5-tools. | and if required, also install python and hdf5-tools. | ||
Unfortunately, only single-processor xds runs smoothly, whereas the parallel xds_par stops with an error message. | Unfortunately, only single-processor xds runs smoothly, whereas the parallel xds_par stops with an error message. This is the workaround: | ||
# since xds_par does not work anyway, just copy the xds binary over the xds_par binary so that it is available under both names | |||
# in XDS.INP, specify MAXIMUM_NUMBER_OF_JOBS= <number of cores> | |||
This will then use process-level parallelization instead of thread-level parallelization, and works rather well. |