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" != "$GMXLDLIB"; then
  11     if test "${tmppath}" == ""; then
  12       tmppath=$i
  13     else
  14     tmppath=${tmppath}:$i
  15   fi
  16   fi
  17 done
  18 LD_LIBRARY_PATH=$tmppath
  19
  20 # remove gromacs part of PKG_CONFIG_PATH
  21 tmppath=""
  22 for i in `echo $PKG_CONFIG_PATH | sed "s/:/ /g"`; do
  23   if test "$i" != "$GMXLDLIB/pkgconfig"; then
  24     tmppath=${tmppath}:$i
  25   fi
  26 done
  27 PKG_CONFIG_PATH=$tmppath
  28
  29 # remove gromacs part of path
  30 tmppath=""
  31 for i in `echo $PATH | sed "s/:/ /g"`; do
  32   if test "$i" != "$GMXBIN"; then
  33     tmppath=${tmppath}:$i
  34   fi
  35 done
  36 PATH=$tmppath
  37
  38 # and remove the gmx part of manpath
  39 tmppath=""
  40 for i in `echo $MANPATH | sed "s/:/ /g"`; do
  41   if test "$i" != "$GMXMAN"; then
  42     tmppath=${tmppath}:$i
  43   fi
  44 done
  45 if test "$tmppath" == ""; then
  46     tmppath=":"
  47 fi
  48 MANPATH=$tmppath
  49
  50 ##########################################################
  51 # This is the real configuration part. We save the Gromacs
  52 # things in separate vars, so we can remove them later.
  53 # If you move gromacs, change the next four line.
  54 ##########################################################
  55 GMXBIN=@bindir@
  56 GMXLDLIB=@libdir@
  57 GMXMAN=@mandir@
  58 GMXDATA=@datadir@
  59
  60 # NB: The variables already begin with ':' now, or are empty
  61 LD_LIBRARY_PATH=${GMXLDLIB}${LD_LIBRARY_PATH}
  62 PKG_CONFIG_PATH=${GMXLDLIB}/pkgconfig${PKG_CONFIG_PATH}
  63 PATH=${GMXBIN}${PATH}
  64 MANPATH=${GMXMAN}${MANPATH}
  65
  66 # export should be separate, so /bin/sh understands it
  67 export GMXBIN GMXLDLIB GMXMAN GMXDATA LD_LIBRARY_PATH PATH MANPATH PKG_CONFIG_PATH
  68
  69 # read bash completions if understand how to use them
  70 # and this shell supports extended globbing
  71 if (complete) > /dev/null 2>&1; then
  72   if (shopt -s extglob) > /dev/null 2>&1; then
  73     if [ -f $GMXBIN/completion.bash ]; then
  74       source $GMXBIN/completion.bash;
  75     fi
  76   fi
  77 fi
  78
  79