global job_params
global system
#
#
# Source file with utility procedures
  source [SearchPath TOP utils map_utils.tcl]
#
# Write the par file

  set logfile $job_params(LOG_FILE)
  set arpwarpdir $job_params(JOB_ID)_$job_params(TASKNAME) 
  set workdir [GetDefaultDirPath]

  set parfile "$workdir/$arpwarpdir.par"

  append partext "set parfile = $parfile\n"
  append partext "set WORKDIR = [GetDefaultDirPath]\n"
  append partext "set PROJECT = $job_params(PROJECT)\n"
  append partext "set JOB_ID = $job_params(JOB_ID) \n"
  append partext "set fulllogfile = " [FileJoin [GetDefaultDirPath]  \
     $job_params(JOB_ID)_warp_nuce_details.log ] \n 
  append partext "set wilsonlogfile = " [FileJoin [GetDefaultDirPath]  \
     $job_params(JOB_ID)_warp_wilson.log ] \n 
  append partext "set warpbin = [GetEnvPath warpbin]\n"

# Put the name of the CCP4i def file  into the par file
  append partext "set CCP4I_DEFFILE = " [FileJoin [GetDefaultDirPath]  \
     CCP4_DATABASE $job_params(JOB_ID)_$job_params(TASKNAME).def ] \n

    AddOutputFile $XYZOUT PROJECT
    AddOutputFile $WILSON_LOG PROJECT
  
# Handle file names

  foreach par [list HKLIN XYZOUT COMPARETO] arppar [list datafile pdbfileout compareto] {
    set file [subst $[subst $par]]
    set dir [subst DIR_$[subst $par]]
    set value [GetFullFileName1 $file $dir]
    if { $value == "" } {
      append partext "set $arppar = ''" \n
    } else {
      append partext "set $arppar = $value" \n
    }
  }

# Basic params

set sizevalue [ expr $NRES * 8 ]

    foreach \
       par [ list NRES NNUC WILSON_B SOLVENTC FP FP    SIGFP PHIB FOM] \
    arppar [ list nres nnuc wilsonb  solventc fp fbest sigfp phib fom] {
	set value [subst $[subst $par]]
        append partext "set $arppar = $value" \n
	}


  GetCellfromMtz $HKLIN mtz_space_group cell lattice
  set space_gp_number [GetSpaceGroupNumber $SPACE_GROUP]

#  puts $space_gp_number
  
  append partext "set sym = $space_gp_number" \n
  append partext "set resol = '$RESOL '" \n
  append partext "set xyzlim = '$XYZLIM '" \n
#  append partext "set fbest = " \n
  append partext "set version = 7.4" \n
  

if { [file exists $parfile] } {
	   file delete -force -- $parfile
}

   WriteFile $parfile $partext
 
   file attributes $parfile -permissions 0740

   AddOutputFile $parfile PROJECT

   catch {exec [GetEnvPath warpbin]/warp_nuce.sh  $parfile >> $logfile}