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delete useless packages
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11 changed files with 0 additions and 165 deletions
9
avogadrolibs/.gitignore
vendored
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avogadrolibs/.gitignore
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# makepkg files
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pkg/
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src/
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*.log
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*.xz
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*.zst
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# source files
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avogadrolibs
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# Maintainer: Eric Berquist <eric DOT berquist AT gmail DOT com>
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pkgname=avogadrolibs
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pkgver=1.95.1
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pkgrel=2
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pkgdesc="Avogadro libraries provide 3D rendering, visualization, analysis and data processing useful in computational chemistry, molecular modeling, bioinformatics, materials science, and related areas"
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url="http://openchemistry.org/projects/avogadro2"
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arch=("x86_64")
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license=("BSD-Clause")
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depends=("libarchive" "glew" "hdf5" "vtk" "libmsym" "spglib" "libmmtf" "qt5-webview" "qt5-x11extras" "molequeue" "pybind11" "python-cclib")
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# gdal is for proj, which is optional for VTK but required here? same for openmpi
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# `msgpack-c` is a workaround for the broken libmmtf PKGBUILD
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makedepends=("cmake" "eigen" "gtest" "gdal" "openmpi" "msgpack-cxx" "msgpack-c" "make")
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conflicts=("${pkgname}")
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provides=("${pkgname}")
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source=("https://github.com/OpenChemistry/avogadrolibs/archive/refs/tags/${pkgver}.zip")
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sha256sums=('5b69fd1216e49fde04816e257fb60819c47bc711317827f2759a26295309ed5a')
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build() {
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mkdir -p "${srcdir}"/build
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cd "${srcdir}"/build
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cmake \
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-DCMAKE_BUILD_TYPE=Release \
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-DCMAKE_INSTALL_PREFIX=/usr \
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-DCMAKE_INSTALL_LIBDIR=lib \
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-DBUILD_SHARED_LIBS=ON \
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-DENABLE_TESTING=ON \
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-DUSE_HDF5=ON \
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-DUSE_VTK=ON \
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-DUSE_MMTF=ON \
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-DUSE_PYTHON=ON \
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-DPYTHON_EXECUTABLE=/usr/bin/python \
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"${srcdir}/${pkgname}-$pkgver"
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make
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}
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check() {
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cd "${srcdir}"/build
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make test
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}
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package() {
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cd "${srcdir}"/build
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make DESTDIR="${pkgdir}" install
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install -D -m 644 "${srcdir}/${pkgname}-$pkgver"/LICENSE "${pkgdir}/usr/share/licenses/${pkgname}/LICENSE"
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}
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#!/usr/bin/env python3
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from lilaclib import *
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def pre_build():
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update_pkgver_and_pkgrel(_G.newver.lstrip('v'))
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def post_build():
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git_add_files('PKGBUILD')
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git_commit()
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build_prefix: extra-x86_64
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maintainers:
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- github: starsareintherose
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email: starsareintherose@outlook.com
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update_on:
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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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repo_depends:
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- python-cclib
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8
python-cclib/.gitignore
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8
python-cclib/.gitignore
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# makepkg files
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pkg/
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src/
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*.xz
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# source files
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*.gz
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cclib/
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# Maintainer: Eric Berquist <eric dot berquist at gmail dot com>
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_name="cclib"
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pkgname="python-${_name}"
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pkgver=1.6.2
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pkgrel=2
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pkgdesc="A library for parsing and interpreting the results of computational chemistry packages."
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arch=("any")
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url="http://cclib.github.io"
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license=("BSD-3-Clause")
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makedepends=("python-setuptools")
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depends=("python-numpy" "python-packaging" "python-periodictable")
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optdepends=('python-openbabel: for generating `OBMol`s of results'
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'python-biopython: for generating `BioPython.Atom`s of parsed results'
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'python-pandas: for generating DataFrames of parsed results'
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'python-scipy: for calculating properties of nuclear configurations')
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source=("https://github.com/${_name}/${_name}/archive/v${pkgver}.tar.gz")
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sha256sums=('ece7b34a487f7483763ef997fa527b8a8c3e1963796df0a9dbf3bab85a686338')
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package() {
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cd "${srcdir}/${_name}-${pkgver}"
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python setup.py install --root="${pkgdir}" --optimize=1
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install -D -m644 LICENSE "${pkgdir}"/usr/share/licenses/${pkgname}/LICENSE
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}
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#!/usr/bin/env python3
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from lilaclib import *
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def pre_build():
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update_pkgver_and_pkgrel(_G.newver.lstrip('v'))
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def post_build():
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git_add_files('PKGBUILD')
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git_commit()
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@ -1,11 +0,0 @@
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build_prefix: extra-x86_64
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maintainers:
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- github: starsareintherose
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email: starsareintherose@outlook.com
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update_on:
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- source: github
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github: cclib/cclib
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use_max_tag: true
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include_regex: v(\d+.\d+.\d+ | \d+.\d+)
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repo_depends:
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- python-periodictable
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# Maintainer: Ross Whitfield <whitfieldre@ornl.gov>
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pkgname='python-periodictable'
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_pkgname='periodictable'
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pkgver=1.6.0
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pkgrel=1
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pkgdesc="Extensible periodic table of the elements"
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url="http://periodictable.readthedocs.org"
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arch=("any")
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license=('public domain')
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makedepends=('python-setuptools')
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source=("https://github.com/pkienzle/periodictable/archive/v$pkgver.tar.gz")
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md5sums=('7fe922ea0ed6b1c568ce3b1aa3d731ed')
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package() {
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depends=('python-numpy' 'python-pyparsing')
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cd "$srcdir/${_pkgname}-$pkgver"
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python setup.py install --root="$pkgdir/" --optimize=1
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}
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@ -1,10 +0,0 @@
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#!/usr/bin/env python3
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from lilaclib import *
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def pre_build():
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update_pkgver_and_pkgrel(_G.newver.lstrip('v'))
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def post_build():
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git_add_files('PKGBUILD')
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git_commit()
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build_prefix: extra-x86_64
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maintainers:
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- github: starsareintherose
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email: starsareintherose@outlook.com
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update_on:
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- source: github
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github: pkienzle/periodictable
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use_max_tag: true
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include_regex: v(\d+.\d+.\d+)
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