diff options
Diffstat (limited to 'openbabel.sh')
| -rwxr-xr-x | openbabel.sh | 100 |
1 files changed, 0 insertions, 100 deletions
diff --git a/openbabel.sh b/openbabel.sh deleted file mode 100755 index 3016d95..0000000 --- a/openbabel.sh +++ /dev/null @@ -1,100 +0,0 @@ -#!/bin/sh -# -# Installs Openbabel. -# A configuration file is created and included in your '$OT_UI_CONF'. -# Author: Christoph Helma, Andreas Maunz. -# - -. "`pwd`/utils.sh" -DIR="`pwd`" - -if [ "$(id -u)" = "0" ]; then - echo "This script must be run as non-root." 1>&2 - exit 1 -fi - -# Utils -WGET="`which wget`" -if [ ! -e "$WGET" ]; then - echo "'wget' missing. Install 'wget' first. Aborting..." - exit 1 -fi - -# Pkg -LOG="$HOME/tmp/`basename $0`-log.txt" - -echo -echo "Openbabel ('$OB_DEST', '$LOG'):" - - -mkdir "$OB_DEST" >/dev/null 2>&1 -if [ ! -d "$OB_DEST" ]; then - echo "Install directory '$OB_DEST' is not available! Aborting..." - exit 1 -else - if ! rmdir "$OB_DEST" >/dev/null 2>&1; then # if not empty this will fail - OB_DONE=true - fi -fi - -if [ ! $OB_DONE ]; then - cd "$HOME/tmp">>$LOG 2>/dev/null - URI="http://downloads.sourceforge.net/project/openbabel/openbabel/$OB_NUM_VER/$OB_VER.tar.gz?use_mirror=kent" - if ! [ -d "$HOME/tmp/$OB_VER" ]; then - cmd="$WGET $URI" && run_cmd "$cmd" "Download" - cmd="tar zxf $OB_VER.tar.gz?use_mirror=kent $OB_VER" && run_cmd "$cmd" "Unpack" - fi - cd "$HOME/tmp/$OB_VER">>$LOG 2>/dev/null - - cmd="./configure --prefix=$OB_DEST" && run_cmd "$cmd" "Configure" - cmd="make" && run_cmd "$cmd" "Make" - cmd="make install" && run_cmd "$cmd" "Install" -fi - -if [ ! -f "$OB_CONF" ]; then - - echo "if echo \"\$PATH\" | grep -v \"$OB_DEST\">/dev/null 2>&1; then export PATH=\"$OB_DEST/bin:\$PATH\"; fi" >> "$OB_CONF" - echo "if echo \"\$LD_LIBRARY_PATH\" | grep -v \"$OB_DEST\">/dev/null 2>&1; then export LD_LIBRARY_PATH=\"$OB_DEST/lib:\$LD_LIBRARY_PATH\"; fi" >> "$OB_CONF" - echo "if ! [ -d \"$OB_DEST\" ]; then echo \"\$0: '$OB_DEST' is not a directory!\"; fi" >> "$OB_CONF" - - echo "if [ -z \"\$BABEL_LIBDIR\" ]; then export BABEL_LIBDIR=\"$OB_DEST/lib/openbabel/$OB_NUM_VER\"; fi" >> "$OB_CONF" - echo "if ! [ -d \"\$BABEL_LIBDIR\" ]; then echo \"\$0: '\$BABEL_LIBDIR' is not a directory!\"; fi" >> "$OB_CONF" - - echo "if [ -z \"\$BABEL_DATADIR\" ]; then export BABEL_DATADIR=\"$OB_DEST/share/openbabel/$OB_NUM_VER\"; fi" >> "$OB_CONF" - echo "if ! [ -d \"\$BABEL_DATADIR\" ]; then echo \"\$0: '\$BABEL_DATADIR' is not a directory!\"; fi" >> "$OB_CONF" - - echo "if echo \"\$RUBYLIB\" | grep -v \"$OB_DEST_BINDINGS\">/dev/null 2>&1; then export RUBYLIB=\"$OB_DEST_BINDINGS:\$RUBYLIB\"; fi" >> "$RUBY_CONF" - echo "if ! [ -d \"$OB_DEST_BINDINGS\" ]; then echo \"\$0: '$OB_DEST_BINDINGS' is not a directory!\"; fi" >> "$RUBY_CONF" - - echo "Openbabel configuration has been stored in '$OB_CONF'." - if ! grep "$OB_CONF" $OT_UI_CONF >/dev/null 2>&1 ; then - echo ". \"$OB_CONF\"" >> $OT_UI_CONF - fi - -fi - -echo "Bindings:" -OB_DONE=false -. "$OT_UI_CONF" -mkdir -p "$OB_DEST_BINDINGS">/dev/null 2>&1 -if [ ! -d "$OB_DEST_BINDINGS" ]; then - echo "Install directory '$OB_DEST_BINDINGS' is not available! Aborting..." - exit 1 -else - if [ "`ls $OB_DEST_BINDINGS | wc -l`" -gt 0 ]; then - OB_DONE=true - fi -fi - -if ! $OB_DONE ; then - OB_SRC_DIR="$HOME/tmp/$OB_VER/scripts/ruby/" - cd "$OB_SRC_DIR" - cmd="ruby extconf.rb --with-openbabel-include=$OB_DEST/include/openbabel-2.0 --with-openbabel-lib=$OB_DEST/lib" && run_cmd "$cmd" "Code" - cmd="make" && run_cmd "$cmd" "Make" - cmd="cp openbabel.so $OB_DEST_BINDINGS" && run_cmd "$cmd" "Install" - cmd="ln -sf $OB_DEST_BINDINGS/openbabel.so $RUBY_DEST/lib/ruby/site_ruby/1.8/`uname -m`-linux/" && run_cmd "$cmd" "Link" - cd "$DIR" - . "`pwd`/utils.sh" - cmd="ruby test-ob-rb.rb" && run_cmd "$cmd" "Load" -fi - |