* update avogadrolibs to 1.99.0-6
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avogadrolibs/.SRCINFO
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62
avogadrolibs/.SRCINFO
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pkgbase = avogadrolibs
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pkgdesc = Libraries that provide 3D rendering, visualization, analysis and data processing useful in computational chemistry, molecular modeling, bioinformatics, materials science, and related areas
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pkgver = 1.99.0
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pkgrel = 6
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url = https://www.openchemistry.org/
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arch = x86_64
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license = custom
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makedepends = boost
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makedepends = cmake
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makedepends = eigen
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makedepends = fast_float
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makedepends = fmt
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makedepends = git
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makedepends = hdf5
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makedepends = genxrdpattern
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makedepends = glew
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makedepends = libmsym
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makedepends = mmtf-cpp
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makedepends = nlohmann-json
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makedepends = openmpi
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makedepends = pybind11
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makedepends = python
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makedepends = qt5-svg
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makedepends = qt5-tools
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makedepends = spglib
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makedepends = tbb
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makedepends = utf8cpp
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makedepends = verdict
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makedepends = vtk
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source = git+https://github.com/OpenChemistry/avogadrolibs#tag=1.99.0
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sha256sums = ad26ef7d887924a867c5aba68ecc3803b2684652d65a442516903c9343a332ff
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pkgname = avogadrolibs
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depends = avogadro-crystals
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depends = avogadro-fragments
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depends = avogadro-molecules
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depends = gcc-libs
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depends = glew
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depends = glibc
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depends = hdf5
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depends = libglvnd
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depends = molequeue
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depends = pugixml
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depends = spglib
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depends = verdict
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optdepends = avogadrolibs-qt5: For the VTK and Qt plugins
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pkgname = avogadrolibs-qt5
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pkgdesc = Qt 5 modules for Avogadro
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depends = avogadrolibs
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depends = fmt
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depends = gcc-libs
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depends = glew
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depends = glibc
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depends = libarchive
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depends = libglvnd
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depends = libmsym
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depends = libxcursor
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depends = openmpi
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depends = qt5-base
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depends = qt5-svg
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depends = vtk
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4
avogadrolibs/.nvchecker.toml
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4
avogadrolibs/.nvchecker.toml
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[avogadrolibs]
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source = 'github'
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github = 'OpenChemistry/avogadrolibs'
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use_max_tag = true
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@ -2,9 +2,10 @@
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# Maintainer: Antonio Rojas <arojas@archlinux.org>
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pkgbase=avogadrolibs
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pkgname=(avogadrolibs)
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pkgname=(avogadrolibs
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avogadrolibs-qt5)
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pkgver=1.99.0
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pkgrel=4
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pkgrel=6
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pkgdesc='Libraries that provide 3D rendering, visualization, analysis and data processing useful in computational chemistry, molecular modeling, bioinformatics, materials science, and related areas'
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arch=(x86_64 powerpc64le powerpc64 powerpc riscv64)
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url='https://www.openchemistry.org/'
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@ -14,6 +15,7 @@ makedepends=(boost
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eigen
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fast_float
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fmt
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git
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hdf5
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genxrdpattern
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glew
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@ -23,6 +25,7 @@ makedepends=(boost
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openmpi
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pybind11
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python
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qt5-svg
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qt5-tools
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qt6-5compat
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qt6-declarative
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@ -33,14 +36,13 @@ makedepends=(boost
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utf8cpp
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verdict
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vtk)
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source=(https://github.com/OpenChemistry/avogadrolibs/archive/$pkgver/$pkgname-$pkgver.tar.gz
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https://github.com/antonio-rojas/avogadrolibs/commit/6e2e84db.patch)
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sha256sums=('34808e3c602b0f60f3c160ff0220832aee777db86e962e3f958c6327fb434063'
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'285d7b8aef7cd489a2829840519051dbdbe232c06a540268860a3a6dbc8d5ca9')
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source=(git+https://github.com/OpenChemistry/avogadrolibs#tag=$pkgver)
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sha256sums=('ad26ef7d887924a867c5aba68ecc3803b2684652d65a442516903c9343a332ff')
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prepare() {
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mkdir crystals fragments molecules # Dummy dirs to trick cmake, actually provided by avogadro-{crystals,fragments,molecules}
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patch -d $pkgname-$pkgver -p1 < 6e2e84db.patch # Fix wrong cmake variable name
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cd $pkgname
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git cherry-pick -n 6e2e84dbb088a40d69117c1836f4306792f57acd # Fix wrong cmake variable name
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}
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build() {
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@ -51,7 +53,7 @@ build() {
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;;
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esac
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cmake -B build -S $pkgname-$pkgver \
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cmake -B build -S $pkgname \
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-DCMAKE_INSTALL_PREFIX=/usr \
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-DCMAKE_C_FLAGS="$CFLAGS -ffat-lto-objects" \
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-DCMAKE_CXX_FLAGS="$CXXFLAGS -ffat-lto-objects" \
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@ -88,5 +90,30 @@ package_avogadrolibs() {
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"$pkgdir"/usr/include/avogadro/{molequeue,qt*,vtk} \
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"$pkgdir"/usr/lib/avogadro2/{scripts,staticplugins}
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install -Dm644 $pkgname-$pkgver/LICENSE -t "$pkgdir"/usr/share/licenses/$pkgname
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install -Dm644 $pkgname/LICENSE -t "$pkgdir"/usr/share/licenses/$pkgname
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}
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package_avogadrolibs-qt5() {
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pkgdesc="Qt 5 modules for Avogadro"
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depends=(avogadrolibs
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fmt # needed by VTK dependencies
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gcc-libs
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glew
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glibc
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libarchive
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libglvnd
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libmsym
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libxcursor # needed by VTK dependencies
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openmpi # needed by VTK dependencies
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qt5-base
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qt5-svg
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vtk)
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DESTDIR="$pkgdir" cmake --install build/avogadro/molequeue
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DESTDIR="$pkgdir" cmake --install build/avogadro/qtgui
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DESTDIR="$pkgdir" cmake --install build/avogadro/qtopengl
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DESTDIR="$pkgdir" cmake --install build/avogadro/qtplugins
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DESTDIR="$pkgdir" cmake --install build/avogadro/vtk
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install -Dm644 $pkgbase/LICENSE -t "$pkgdir"/usr/share/licenses/$pkgname
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}
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