# # Copyright (C) 1999-2004 Liz Potterton, Peter Briggs # # This code is distributed under the terms and conditions of the # CCP4 Program Suite Licence Agreement as a CCP4 Library. # A copy of the CCP4 licence can be obtained by writing to the # CCP4 Secretary, Daresbury Laboratory, Warrington WA4 4AD, UK. # #====================================================================== # # r500 script # #====================================================================== ####################################################################### # Change to the rundir ####################################################################### set rundir [GetDefaultDirPath] # Change to the project directory cd $rundir ####################################################################### CreateComScript r500 r500_script set cmd "[BinPath r500ccp4] \"$XYZIN\"" set status [Execute "$cmd" program_status report ] AddOutputFile [ format { %s.rem500 } $XYZIN ] PROJECT [ format { %srem500.cif } $XYZIN ]