#!/bin/csh -f # # mtzdmp script # if ($#argv == 0) then # #---- no filename given, read it # echo -n "Input file name: " set File_Name = $< else set File_Name = $argv[1] endif # # if ($#argv == 1) then # #--- test for help # if ($argv[1] == "-h") then echo " " echo "mtzdmp -n Number : number of hkl to dump (def 10) " echo "mtzdmp -e : print HEADER only" echo "mtzdmp -b : dump BATCH headers" echo "mtzdmp -s : dump SYMMETRY info" echo "mtzdmp -bs (-sb) : dump both SYMM and BATCH" echo "mtzdmp -r Rmax (Rmin) : resolution limits" echo "mtzdmp -i : Interactive" echo " " exit endif set File_Name = $argv[1] endif #---- test if $1 is a file name if (! -e $File_Name) then #--- well then test if $1.mtz is a file set File_Name=$File_Name".mtz" if (! -e $File_Name) then echo "mtzdmp: no file: `basename $File_Name .mtz`[.mtz]" exit 1 endif endif if ($#argv == 1) then mtzdump hklin $File_Name < /dev/null exit $status endif # shift set XHEAD=" " set XBATCH=" " set XSYMM=" " set XNREF=" " set XRESO=" " while ($#argv) switch ( "$1" ) case '-n': # check there is another arg if ($#argv >= 2) then shift set XNREF="NREF $1" else set XNREF="NREF 10" endif breaksw case '-e': set XHEAD="HEAD" breaksw case '-b': set XBATCH="BATCH" breaksw case '-s': set XSYMM="SYMMETRY" breaksw case '-r': if ($#argv >= 2) then shift set XRESO="RESOLUTION $1" if ($#argv >= 2) then shift set XRESO="${XRESO} "$1 endif else set XRESO=" " endif breaksw case '-sb': set XSYMM="SYMMETRY" set XBATCH="BATCH" breaksw case '-bs': set XSYMM="SYMMETRY" set XBATCH="BATCH" breaksw case '-h': echo " " echo "mtzdmp -n Number : number of hkl to dump (def 10) " echo "mtzdmp -e : print HEADER only" echo "mtzdmp -b : dump BATCH headers" echo "mtzdmp -s : dump SYMMETRY info" echo "mtzdmp -bs (-sb) : dump both SYMM and BATCH" echo "mtzdmp -r Rmax (Rmin) : resolution limits" echo "mtzdmp -i : Interactive" echo " " exit breaksw case '-i': # #---- interactive # goto INTERACTIVE breaksw default: # #--- assume number for number of reflections # set XNREF="NREF "$1 breaksw endsw shift end mtzdump hklin $File_Name <