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academic/wxmacmolplt: Updated for version 7.4
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6 changed files with 36 additions and 24 deletions
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@ -1,8 +1,7 @@
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The MacMolPlt molecular visualization program
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MacMolPlt is designed to display the input and output of
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the GAMESS(US) and PCGAMESS quantum chemistry packages.
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It produces animations and/or publication quality output
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from a variety of input file formats.
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MacMolPlt is designed to display the input and output of the GAMESS(US)
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and PCGAMESS quantum chemistry packages. It produces animations and/or
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publication quality output from a variety of input file formats.
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wxMacMolPlt requres wxGTK built with OpenGL support.
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This requires wxGTK built with OpenGL support.
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# leave one space after the ':'.
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|-----handy-ruler------------------------------------------------------|
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wxmacmolplt: MacMolPlt (molecular visualization program)
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wxmacmolplt: wxmacmolplt (The MacMolPlt molecular visualization program)
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wxmacmolplt:
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wxmacmolplt: MacMolPlt is designed to display the input and output of
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wxmacmolplt: the GAMESS quantum chemistry package. It produces animations
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11
academic/wxmacmolplt/wxmacmolplt-7.4-firefly.patch
Normal file
11
academic/wxmacmolplt/wxmacmolplt-7.4-firefly.patch
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--- a/src/BFiles.cpp 2009-11-13 06:42:20.000000000 +0300
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+++ b/src/BFiles.cpp 2009-12-09 21:08:16.000000000 +0300
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@@ -294,6 +294,8 @@
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while ((ByteCount <= FileSize)&&(Type == kUnknown)) {
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if (LocateKeyWord("GAMESS VERSION", 14, -1))
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Type = kGAMESSlogType;
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+ else if (LocateKeyWord("Firefly (PC GAMESS) version", 27, -1))
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+ Type = kGAMESSlogType;
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else if (LocateKeyWord("===== IRC DATA PACKET", 21, -1))
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Type = kGAMESSTRJType;
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else if (LocateKeyWord("===== DRC DATA PACKET", 21, -1))
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@ -5,9 +5,9 @@
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# Written by Daniil Bratashov <dn2010@gmail.com>
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PRGNAM=wxmacmolplt
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VERSION=${VERSION:-7.3}
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VERSION=${VERSION:-7.4}
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ARCH=${ARCH:-i486}
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BUILD=${BUILD:-1}
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BUILD=${BUILD:-2}
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TAG=${TAG:-_SBo}
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CWD=$(pwd)
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@ -35,9 +35,6 @@ rm -rf $PRGNAM-$VERSION
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tar xvf $CWD/$PRGNAM-$VERSION.tar.gz
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cd $PRGNAM-$VERSION
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# Fix for PCGAMESS new raman activities format
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patch -p1 -E < $CWD/wxmacmolplt-7.2.1-raman.patch
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chown -R root:root .
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find . \
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\( -perm 777 -o -perm 775 -o -perm 711 -o -perm 555 -o -perm 511 \) \
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\( -perm 666 -o -perm 664 -o -perm 600 -o -perm 444 -o -perm 440 -o -perm 400 \) \
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-exec chmod 644 {} \;
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# Fix for PCGAMESS new raman activities format
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patch -p1 < $CWD/wxmacmolplt-7.2.1-raman.patch
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# Fix for Firefly format autodetection
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patch -p1 < $CWD/wxmacmolplt-7.4-firefly.patch
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CFLAGS="$SLKCFLAGS" \
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CXXFLAGS="$SLKCFLAGS" \
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./configure \
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find . | xargs file | grep "executable" | grep ELF | cut -f 1 -d : | \
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xargs strip --strip-unneeded 2> /dev/null || true
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find . | xargs file | grep "shared object" | grep ELF | cut -f 1 -d : | \
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xargs strip --strip-unneeded 2> /dev/null
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xargs strip --strip-unneeded 2> /dev/null || true
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)
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( cd $PKG/usr/man
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find . -type f -exec gzip -9 {} \;
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for i in $( find . -type l ) ; do ln -s $( readlink $i ).gz $i.gz ; rm $i ; done
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)
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mkdir -p $PKG/usr/share/icons/hicolor/128x128/apps
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mkdir -p $PKG/usr/share/applications
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cp resources/wxmacmolplt.desktop $PKG/usr/share/applications
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( cd $PKG/usr/man
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find . -type f -exec gzip -9 {} \;
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for i in $( find . -type l ) ; do ln -s $( readlink $i ).gz $i.gz ; rm $i ; done
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)
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mkdir -p $PKG/usr/doc/$PRGNAM-$VERSION
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cp -a \
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AUTHORS LICENSE NEWS README \
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$PKG/usr/doc/$PRGNAM-$VERSION
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cp -a AUTHORS LICENSE NEWS README $PKG/usr/doc/$PRGNAM-$VERSION
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cat $CWD/$PRGNAM.SlackBuild > $PKG/usr/doc/$PRGNAM-$VERSION/$PRGNAM.SlackBuild
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mv $PKG/usr/share/$PRGNAM/MacMolPlt_Manual.html $PKG/usr/doc/$PRGNAM-$VERSION
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mv $PKG/usr/share/$PRGNAM/Manual_pages $PKG/usr/doc/$PRGNAM-$VERSION
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cat $CWD/slack-desc > $PKG/install/slack-desc
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cd $PKG
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/sbin/makepkg -l y -c n $OUTPUT/$PRGNAM-$VERSION-$ARCH-$BUILD$TAG.tgz
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/sbin/makepkg -l y -c n $OUTPUT/$PRGNAM-$VERSION-$ARCH-$BUILD$TAG.${PKGTYPE:-tgz}
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PRGNAM="wxmacmolplt"
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VERSION="7.3"
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VERSION="7.4"
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HOMEPAGE="http://www.scl.ameslab.gov/MacMolPlt/"
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DOWNLOAD="http://www.scl.ameslab.gov/MacMolPlt/download/wxmacmolplt-7.3.tar.gz"
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MD5SUM="867071582b2eaff49efdf0bfa2094252"
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DOWNLOAD="http://www.scl.ameslab.gov/MacMolPlt/download/wxmacmolplt-7.4.tar.gz"
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MD5SUM="26e1a2f5e5860334f29edc3b5f5c30e9"
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DOWNLOAD_x86_64=""
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MD5SUM_x86_64=""
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MAINTAINER="Daniil Bratashov"
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EMAIL="dn2010@gmail.com"
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APPROVED="rworkman"
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