Provided by: cod-tools_3.7.0+dfsg-1build1_amd64
NAME
symop_build_spacegroup - determine a space group from a list of symmetry operators (generators), using the Ralf's (Ralf Grosse-Kunstleve) algorithm.
SYNOPSIS
symop_build_spacegroup < input.symop symop_build_spacegroup input.symop symop_build_spacegroup input.symop additional*.symop
DESCRIPTION
Determine a space group from a list of symmetry operators (generators), using the Ralf's (Ralf Grosse-Kunstleve) algorithm.
OPTIONS
-o, --use-optimised-spacegroup-builder Use the space group builder algorithm optimised for speed as implemented in the COD::Spacegroups::Builder module (default). -s, --use-simple-spacegroup-builder Use the simpler and slower space group builder algorithm as implemented in the COD::Spacegroups::SimpleBuilder module. --debug Switch on debug printouts. --no-debug Switch of debug printouts (default). --help, --usage Output a short usage message (this message) and exit. --version Output version information and exit.
REPORTING BUGS
Report symop_build_spacegroup bugs using e-mail: cod-bugs@ibt.lt SYMOP_BUILD_SPACEGROUP(1)