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Diffstat (limited to 'sci-physics/lammps/lammps-20170901-r1.ebuild')
-rw-r--r--sci-physics/lammps/lammps-20170901-r1.ebuild132
1 files changed, 0 insertions, 132 deletions
diff --git a/sci-physics/lammps/lammps-20170901-r1.ebuild b/sci-physics/lammps/lammps-20170901-r1.ebuild
deleted file mode 100644
index 1efe9382d5aa..000000000000
--- a/sci-physics/lammps/lammps-20170901-r1.ebuild
+++ /dev/null
@@ -1,132 +0,0 @@
-# Copyright 1999-2020 Gentoo Authors
-# Distributed under the terms of the GNU General Public License v2
-
-EAPI=6
-
-PYTHON_COMPAT=( python{2_7,3_6} )
-
-inherit cmake-utils fortran-2 python-r1
-
-convert_month() {
- local months=( "" Jan Feb Mar Apr May Jun Jul Aug Sep Oct Nov Dec )
- echo ${months[${1#0}]}
-}
-
-MY_PV="patch_$((10#${PV:6:2}))$(convert_month ${PV:4:2})${PV:0:4}"
-MY_P="${PN}-${MY_PV}"
-
-DESCRIPTION="Large-scale Atomic/Molecular Massively Parallel Simulator"
-HOMEPAGE="https://lammps.sandia.gov/"
-SRC_URI="https://github.com/lammps/lammps/archive/${MY_PV}.tar.gz -> ${MY_P}.tar.gz"
-
-LICENSE="GPL-2"
-SLOT="0"
-KEYWORDS="~amd64 ~x86"
-IUSE="cuda examples gzip lammps-memalign mpi netcdf python test"
-RESTRICT="!test? ( test )"
-
-DEPEND="
- app-arch/gzip
- media-libs/libpng:0
- sys-libs/zlib
- mpi? (
- virtual/mpi
- sci-libs/hdf5[mpi]
- )
- python? ( ${PYTHON_DEPS} )
- sci-libs/voro++
- virtual/blas
- virtual/lapack
- sci-libs/fftw:3.0
- netcdf? ( sci-libs/netcdf )
- cuda? ( >=dev-util/nvidia-cuda-toolkit-4.2.9-r1 )
- dev-cpp/eigen:3
- "
-RDEPEND="${DEPEND}"
-
-REQUIRED_USE="python? ( ${PYTHON_REQUIRED_USE} )"
-
-S="${WORKDIR}/${MY_P}/cmake"
-
-src_configure() {
- local mycmakeargs=(
- -DBUILD_SHARED_LIBS=ON
- -DENABLE_MPI=$(usex mpi)
- -DENABLE_GPU=$(usex cuda)
- -DENABLE_TESTING=$(usex test)
- -DENABLE_ASPHERE=ON
- -DENABLE_BODY=ON
- -DENABLE_CLASS2=ON
- -DENABLE_COLLOID=ON
- -DENABLE_COMPRESS=ON
- -DENABLE_CORESHELL=ON
- -DENABLE_DIPOLE=ON
- -DENABLE_GRANULAR=ON
- -DENABLE_KSPACE=ON
- -DFFT=FFTW3
- -DENABLE_MANYBODY=ON
- -DENABLE_MC=ON
- -DENABLE_MEAM=ON
- -DENABLE_MISC=ON
- -DLAMMPS_XDR=ON #630444
- -DENABLE_MOLECULE=ON
- -DENABLE_PERI=ON
- -DENABLE_QEQ=ON
- -DENABLE_REAX=ON
- -DENABLE_REPLICA=ON
- -DENABLE_RIGID=ON
- -DENABLE_SHOCK=ON
- -DENABLE_SNAP=ON
- -DENABLE_SRD=ON
- -DENABLE_PYTHON=ON
- -DENABLE_MPIIO=$(usex mpi)
- -DENABLE_VORONOI=ON
- -DENABLE_USER-ATC=ON
- -DENABLE_USER-AWPMD=ON
- -DENABLE_USER-CGDNA=ON
- -DENABLE_USER-CGSDK=ON
- -DENABLE_USER-COLVARS=ON
- -DENABLE_USER-DIFFRACTION=ON
- -DENABLE_USER-DPD=ON
- -DENABLE_USER-DRUDE=ON
- -DENABLE_USER-EFF=ON
- -DENABLE_USER-FEP=ON
- -DENABLE_USER-H5MD=$(usex mpi)
- -DENABLE_USER-LB=$(usex mpi)
- -DENABLE_USER-MANIFOLD=ON
- -DENABLE_USER-MEAMC=ON
- -DENABLE_USER-MGPT=ON
- -DENABLE_USER-MISC=ON
- -DENABLE_USER-MOLFILE=ON
- -DENABLE_USER-NETCDF=$(usex netcdf)
- -DENABLE_USER-PHONON=ON
- -DENABLE_USER-QTB=ON
- -DENABLE_USER-REAXC=ON
- -DENABLE_USER-SMD=ON
- -DENABLE_USER-SMTBQ=ON
- -DENABLE_USER-SPH=ON
- -DENABLE_USER-TALLY=ON
- )
- cmake-utils_src_configure
-}
-
-src_install() {
- cmake-utils_src_install
-
- local LAMMPS_POTENTIALS="usr/share/${PN}/potentials"
- insinto "/${LAMMPS_POTENTIALS}"
- doins "${S}"/../potentials/*
- echo "LAMMPS_POTENTIALS=${EROOT}${LAMMPS_POTENTIALS}" > 99lammps
- doenvd 99lammps
-
- # Install python script.
- use python && python_foreach_impl python_domodule "${S}"/../python/lammps.py
-
- if use examples; then
- for d in examples bench; do
- local LAMMPS_EXAMPLES="/usr/share/${PN}/${d}"
- insinto "${LAMMPS_EXAMPLES}"
- doins -r "${S}"/../${d}/*
- done
- fi
-}