slackbuilds/academic/avogadrolibs/avogadrolibs.SlackBuild

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#!/bin/bash
# Slackware build script for avogadrolibs
# Copyright 2020-2022 Giancarlo Dessì, Cagliari, IT
# All rights reserved.
#
# Redistribution and use of this script, with or without modification, is
# permitted provided that the following conditions are met:
#
# 1. Redistributions of this script must retain the above copyright
# notice, this list of conditions and the following disclaimer.
#
# THIS SOFTWARE IS PROVIDED BY THE AUTHOR "AS IS" AND ANY EXPRESS OR IMPLIED
# WARRANTIES, INCLUDING, BUT NOT LIMITED TO, THE IMPLIED WARRANTIES OF
# MERCHANTABILITY AND FITNESS FOR A PARTICULAR PURPOSE ARE DISCLAIMED. IN NO
# EVENT SHALL THE AUTHOR BE LIABLE FOR ANY DIRECT, INDIRECT, INCIDENTAL,
# SPECIAL, EXEMPLARY, OR CONSEQUENTIAL DAMAGES (INCLUDING, BUT NOT LIMITED TO,
# PROCUREMENT OF SUBSTITUTE GOODS OR SERVICES; LOSS OF USE, DATA, OR PROFITS;
# OR BUSINESS INTERRUPTION) HOWEVER CAUSED AND ON ANY THEORY OF LIABILITY,
# WHETHER IN CONTRACT, STRICT LIABILITY, OR TORT (INCLUDING NEGLIGENCE OR
# OTHERWISE) ARISING IN ANY WAY OUT OF THE USE OF THIS SOFTWARE, EVEN IF
# ADVISED OF THE POSSIBILITY OF SUCH DAMAGE.
cd $(dirname $0) ; CWD=$(pwd)
PRGNAM=avogadrolibs
VERSION=${VERSION:-1.97.0}
BUILD=${BUILD:-3}
TAG=${TAG:-_SBo}
PKGTYPE=${PKGTYPE:-tgz}
MVERSION=${MVERSION:-1.0.0}
CVERSION=${CVERSION:-1.0.1}
AVERSION=${AVERSION:-1.97.0}
if [ -z "$ARCH" ]; then
case "$( uname -m )" in
i?86) ARCH=i586 ;;
arm*) ARCH=arm ;;
*) ARCH=$( uname -m ) ;;
esac
fi
if [ ! -z "${PRINT_PACKAGE_NAME}" ]; then
echo "$PRGNAM-$VERSION-$ARCH-$BUILD$TAG.$PKGTYPE"
exit 0
fi
#These are features which are disabled by default
USEHDF5="" ; [ "${HDF5:-no}" = "yes" ] && USEHDF5="-DUSE_HDF5=ON"
USEPYTHON="" ; [ "${PYTHON:-no}" = "yes" ] && USEPYTHON="-DUSE_PYTHON=ON"
USEVTK="" ; [ "${VTK:-no}" = "yes" ] && USEVTK="-DUSE_VTK=ON"
#These are features which are enabled by default
USELIBMSYM="" ; [ "${LIBMSYM:-yes}" = "no" ] && USELIBMSYM="-DUSE_LIBMSYM=OFF"
USESPGLIB="-DSPGLIB_INCLUDE_DIR=/usr/include/spglib" ; [ "${SPGLIB:-yes}" = "no" ] && \
USESPGLIB="-DUSE_SPGLIB=OFF"
USEMMTF="" ; [ "${MMTF:-yes}" = "no" ] && USEMMTF="-DUSE_MMTF=OFF"
TMP=${TMP:-/tmp/SBo}
PKG=$TMP/package-$PRGNAM
OUTPUT=${OUTPUT:-/tmp}
GENXRDPATH=$TMP/$PRGNAM-$VERSION/build/avogadro/qtplugins/plotxrd/bin
if [ "$ARCH" = "i586" ]; then
SLKCFLAGS="-O2 -march=i586 -mtune=i686"
LIBDIRSUFFIX=""
elif [ "$ARCH" = "i686" ]; then
SLKCFLAGS="-O2 -march=i686 -mtune=i686"
LIBDIRSUFFIX=""
elif [ "$ARCH" = "x86_64" ]; then
SLKCFLAGS="-O2 -fPIC"
LIBDIRSUFFIX="64"
else
SLKCFLAGS="-O2"
LIBDIRSUFFIX=""
fi
set -e
rm -rf $PKG
mkdir -p $TMP $PKG $OUTPUT
cd $TMP
rm -rf $PRGNAM-$VERSION molecules crystals avogadrogenerators
tar xvf $CWD/$PRGNAM-$VERSION.tar.gz
# Following archives must be unpacked in /tmp since the build process
# searches them as parallel directories and tries to connect to github
# if not found
tar xvf $CWD/molecules-$MVERSION.tar.gz
tar xvf $CWD/crystals-$CVERSION.tar.gz
mv molecules-$MVERSION molecules
mv crystals-$CVERSION crystals
if [ "${PYTHON}" = "yes" ]; then
tar xvf $CWD/avogenerators-$AVERSION.tar.gz
mv avogenerators-$AVERSION avogadrogenerators
fi
# Now we can change directory to $PRGNAM-$VERSION
cd $PRGNAM-$VERSION
chown -R root:root .
find -L . \
\( -perm 777 -o -perm 775 -o -perm 750 -o -perm 711 -o -perm 555 \
-o -perm 511 \) -exec chmod 755 {} \; -o \
\( -perm 666 -o -perm 664 -o -perm 640 -o -perm 600 -o -perm 444 \
-o -perm 440 -o -perm 400 \) -exec chmod 644 {} \;
# fix issues that generate cmake warnings
patch -p1 < $CWD/fix_cmake-find-package.diff
# fix build error cause ambiguous definition in source code
# (thanks to StefanBruens from OpenChemistry in GitHub)
patch -p1 < $CWD/fix_mmtfformat_cpp.diff
mkdir -p build
# Following steps prevent the download of the executable genXrdPattern
# needed by the build process and include it in the source tree
mkdir -p $GENXRDPATH
cp $CWD/linux64-genXrdPattern $GENXRDPATH
mv $GENXRDPATH/linux64-genXrdPattern $GENXRDPATH/genXrdPattern
chmod 755 $GENXRDPATH/genXrdPattern
cd build
cmake \
-DCMAKE_C_FLAGS:STRING="$SLKCFLAGS" \
-DCMAKE_CXX_FLAGS:STRING="$SLKCFLAGS" \
-DCMAKE_INSTALL_PREFIX=/usr \
-DCMAKE_BUILD_TYPE=Release \
-DCMAKE_POLICY_DEFAULT_CMP0072=NEW \
-DENABLE_TESTING=OFF \
-DENABLE_TRANSLATIONS=ON \
$USEHDF5 \
$USEPYTHON \
$USELIBMSYM \
$USESPGLIB \
$USEMMTF \
$USEVTK \
..
make
make install DESTDIR=$PKG
cd ..
rm -f $PKG/{,usr/}lib${LIBDIRSUFFIX}/*.la
find $PKG -print0 | xargs -0 file | grep -e "executable" -e "shared object" | grep ELF \
| cut -f 1 -d : | xargs strip --strip-unneeded 2> /dev/null || true
mkdir -p $PKG/usr/doc/$PRGNAM-$VERSION
cp -a *.md LICENSE CITATION.cff $PKG/usr/doc/$PRGNAM-$VERSION
cat $CWD/$PRGNAM.SlackBuild > $PKG/usr/doc/$PRGNAM-$VERSION/$PRGNAM.SlackBuild
# Remove doc files installed by make install in /usr/share/doc/AvogadroLibs that are redundant
rm -rf $PKG/usr/share/doc
mkdir -p $PKG/install
cat $CWD/slack-desc > $PKG/install/slack-desc
cd $PKG
/sbin/makepkg -l y -c n $OUTPUT/$PRGNAM-$VERSION-$ARCH-$BUILD$TAG.$PKGTYPE