scripts/GMXRC.bash.in

   1 # zsh configuration file for Gromacs
   2 # First we remove old gromacs stuff from the paths
   3 # by selecting everything else.
   4 # This is not 100% necessary, but very useful when we
   5 # repeatedly switch between gmx versions in a shell.
   6
   7 # First remove gromacs part of ld_library_path
   8 tmppath=""
   9 for i in `echo $LD_LIBRARY_PATH | sed "s/:/ /g"`; do
  10   if test "$i" != "$GMXLDLIB"; then
  11     tmppath=${tmppath}:$i
  12   fi
  13 done
  14 LD_LIBRARY_PATH=$tmppath
  15
  16 # remove gromacs part of path
  17 tmppath=""
  18 for i in `echo $PATH | sed "s/:/ /g"`; do
  19   if test "$i" != "$GMXBIN"; then
  20     tmppath=${tmppath}:$i
  21   fi
  22 done
  23 PATH=$tmppath
  24
  25 # and remove the gmx part of manpath
  26 tmppath=""
  27 for i in `echo $MANPATH | sed "s/:/ /g"`; do
  28   if test "$i" != "$GMXMAN"; then
  29     tmppath=${tmppath}:$i
  30   fi
  31 done
  32 MANPATH=$tmppath
  33
  34 ##########################################################
  35 # This is the real configuration part. We save the Gromacs
  36 # things in separate vars, so we can remove them later.
  37 # If you move gromacs, change the next four line.
  38 ##########################################################
  39 GMXBIN=@bindir@
  40 GMXLDLIB=@libdir@
  41 GMXMAN=@mandir@
  42 GMXDATA=@datadir@
  43
  44 # NB: The variables already begin with ':' now, or are empty
  45 LD_LIBRARY_PATH=${GMXLDLIB}${LD_LIBRARY_PATH}
  46 PATH=${GMXBIN}${PATH}
  47 MANPATH=${GMXMAN}${MANPATH}
  48
  49 # export should be separate, so /bin/sh understands it
  50 export GMXBIN GMXLDLIB GMXMAN GMXDATA LD_LIBRARY_PATH PATH MANPATH
  51
  52 # read bash completions if understand how to use them
  53 # and this shell supports extended globbing
  54 if (complete) > /dev/null 2>&1; then
  55   if (shopt -s extglob) > /dev/null 2>&1; then
  56     if [ -f $GMXBIN/completion.bash ]; then
  57       source $GMXBIN/completion.bash;
  58     fi
  59   fi
  60 fi
  61
  62