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-rw-r--r--sci-chemistry/relion/Manifest3
-rw-r--r--sci-chemistry/relion/files/relion-4.0.0-build.patch39
-rw-r--r--sci-chemistry/relion/metadata.xml3
-rw-r--r--sci-chemistry/relion/relion-3.1.1.ebuild44
-rw-r--r--sci-chemistry/relion/relion-4.0.0.ebuild71
-rw-r--r--sci-chemistry/relion/relion-9999.ebuild69
6 files changed, 184 insertions, 45 deletions
diff --git a/sci-chemistry/relion/Manifest b/sci-chemistry/relion/Manifest
index 6aa383614..75b932e28 100644
--- a/sci-chemistry/relion/Manifest
+++ b/sci-chemistry/relion/Manifest
@@ -1 +1,2 @@
-DIST relion-3.1.1.tar.gz 2340685 BLAKE2B 0e98db3af7ceb312111260d8af51225d9a6b82314f1f066fe52464b533e59f44f5487ba66110708d661506074be4d52eeb7e04d88344a939bbd33139a33f6dec SHA512 fddf6f8a3d63e4f73aa1f529e4fa8fa7da98d9226b6539530c83496b94793ceef27d013a2d902a794993ab994f8d6467569ea4b681b4dd948654acf482529b22
+DIST class_ranker_0.1.3_torch_1.0.1.pt.tar.gz 2190018 BLAKE2B 157d380693cb97f2f94aea5ee8b1c9b64c50cead45c65d8d95584b12a4901622df025e4bdfccfc9c87286a3d442ffc26ed2a89953b9361f59d7ae2852fcc3a6b SHA512 0e9d4046a9ba211c07abcc44d0b51c7d69805eb946ed96abdd1663760906188050d476268214b4e7a84f529f51226c39f40c3b418373437fae2f4bb24990f338
+DIST relion-4.0.0.tar.gz 3342593 BLAKE2B d2293531cdf3c5779a8f6beb5bc753931388f1c577faa89a927c6ccd72436db0d9a84fbe08b836601b466bc23e9df6500f9e87da1630adecd2b0cf0e245d63e6 SHA512 1e873868bc54a13a7cca74c4a623f5f2aeeec7bd2df04f74d0421127a9c9a3b40a56ebc5b04a9f4138cca1208417b05a30c38ae78106d53b92deeadbeeaf4209
diff --git a/sci-chemistry/relion/files/relion-4.0.0-build.patch b/sci-chemistry/relion/files/relion-4.0.0-build.patch
new file mode 100644
index 000000000..d7cb7bf2e
--- /dev/null
+++ b/sci-chemistry/relion/files/relion-4.0.0-build.patch
@@ -0,0 +1,39 @@
+From 138b9c71b41a3c8782c991053a28bfe074bffdd9 Mon Sep 17 00:00:00 2001
+From: Takanori Nakane <nakane.t@gmail.com>
+Date: Fri, 28 Oct 2022 19:51:29 +0900
+Subject: [PATCH] Repaired the build failure reported in #826 (by
+ @prehensilecode and @acaprez)
+
+---
+ src/apps/CMakeLists.txt | 16 ++++++++--------
+ 1 file changed, 8 insertions(+), 8 deletions(-)
+
+diff --git a/src/apps/CMakeLists.txt b/src/apps/CMakeLists.txt
+index 9870b735..30985aa7 100644
+--- a/src/apps/CMakeLists.txt
++++ b/src/apps/CMakeLists.txt
+@@ -273,16 +273,16 @@ if (CUDA_FOUND)
+
+
+
+- file(GLOB REL_JAZ_CUDA_SRC "${CMAKE_SOURCE_DIR}/src/jaz/cuda/*.cu" "${CMAKE_SOURCE_DIR}/src/jaz/cuda/kernels/*.cu" )
++ file(GLOB REL_JAZ_CUDA_SRC "${CMAKE_SOURCE_DIR}/src/jaz/cuda/*.cu")
+ cuda_add_library(relion_jaz_gpu_util ${REL_JAZ_CUDA_SRC})
+
+- #list(APPEND EXTRA_LIBS "${CUDA_CUFFT_LIBRARIES}")
+- #if(BUILD_SHARED_LIBS)
+- # install (TARGETS relion_jaz_gpu_util LIBRARY DESTINATION lib)
+- #else()
+- # target_link_libraries(relion_jaz_gpu_util relion_lib)
+- # target_link_libraries(relion_jaz_gpu_util ${CUDA_CUFFT_LIBRARIES})
+- #endif()
++ list(APPEND EXTRA_LIBS "${CUDA_CUFFT_LIBRARIES}")
++ if(BUILD_SHARED_LIBS)
++ install (TARGETS relion_jaz_gpu_util LIBRARY DESTINATION lib)
++ else()
++ target_link_libraries(relion_jaz_gpu_util relion_lib)
++ target_link_libraries(relion_jaz_gpu_util ${CUDA_CUFFT_LIBRARIES})
++ endif()
+
+ target_link_libraries(relion_lib relion_jaz_gpu_util ${CUDA_CUFFT_LIBRARIES})
+ target_link_libraries(relion_lib relion_jaz_gpu_util ${CUDA_CUFFT_LIBRARIES} ${CUDA_curand_LIBRARY})
diff --git a/sci-chemistry/relion/metadata.xml b/sci-chemistry/relion/metadata.xml
index 8fe354309..101a056b9 100644
--- a/sci-chemistry/relion/metadata.xml
+++ b/sci-chemistry/relion/metadata.xml
@@ -13,4 +13,7 @@
<flag name="gui">Enable relion gui</flag>
<flag name="cuda">Enable CUDA support</flag>
</use>
+ <upstream>
+ <remote-id type="github">3dem/relion</remote-id>
+ </upstream>
</pkgmetadata>
diff --git a/sci-chemistry/relion/relion-3.1.1.ebuild b/sci-chemistry/relion/relion-3.1.1.ebuild
deleted file mode 100644
index db5753988..000000000
--- a/sci-chemistry/relion/relion-3.1.1.ebuild
+++ /dev/null
@@ -1,44 +0,0 @@
-# Copyright 2019-2021 Gentoo Authors
-# Distributed under the terms of the GNU General Public License v2
-
-EAPI=7
-
-inherit cmake
-
-DESCRIPTION="Image-processing software for cryo-electron microscopy"
-HOMEPAGE="https://www3.mrc-lmb.cam.ac.uk/relion/index.php/Main_Page"
-SRC_URI="https://github.com/3dem/relion/archive/${PV}.tar.gz -> ${P}.tar.gz"
-
-LICENSE="GPL-2"
-SLOT="0"
-KEYWORDS="~amd64"
-IUSE="+gui cuda"
-
-DEPEND="
- gui? ( x11-libs/fltk )
- dev-cpp/tbb
- sci-libs/fftw:3.0
- media-libs/tiff
- virtual/mpi
- cuda? ( dev-util/nvidia-cuda-toolkit )
- "
-RDEPEND="
- ${DEPEND}
- sci-chemistry/ctffind
- cuda? ( sci-chemistry/MotionCor2 )
-"
-BDEPEND="${DEPEND}"
-
-src_configure() {
- CMAKE_BUILD_TYPE=Release
- mycmakeargs=(
- -DBUILD_SHARED_LIBS=ON
- -DALTCPU=$(usex !cuda)
- -DFORCE_OWN_FFTW=OFF
- -DFORCE_OWN_FLTK=OFF
- -DFORCE_OWN_TBB=OFF
- -DCUDA=$(usex cuda)
- -DGUI=$(usex gui)
- )
- cmake_src_configure
-}
diff --git a/sci-chemistry/relion/relion-4.0.0.ebuild b/sci-chemistry/relion/relion-4.0.0.ebuild
new file mode 100644
index 000000000..c6d7d90db
--- /dev/null
+++ b/sci-chemistry/relion/relion-4.0.0.ebuild
@@ -0,0 +1,71 @@
+# Copyright 2019-2021 Gentoo Authors
+# Distributed under the terms of the GNU General Public License v2
+
+EAPI=8
+
+inherit cmake
+
+DESCRIPTION="Image-processing software for cryo-electron microscopy"
+HOMEPAGE="https://www3.mrc-lmb.cam.ac.uk/relion/index.php/Main_Page"
+
+if [[ ${PV} = *9999* ]]; then
+ EGIT_REPO_URI="https://github.com/3dem/relion.git"
+ [[ ${PV} = 9999 ]] && EGIT_BRANCH="master" || EGIT_BRANCH="ver${PV:0:4}"
+ inherit git-r3
+ SRC_URI="ftp://ftp.mrc-lmb.cam.ac.uk/pub/dari/class_ranker_0.1.3_torch_1.0.1.pt.tar.gz"
+else
+ SRC_URI="
+ https://github.com/3dem/relion/archive/${PV}.tar.gz -> ${P}.tar.gz
+ ftp://ftp.mrc-lmb.cam.ac.uk/pub/dari/class_ranker_0.1.3_torch_1.0.1.pt.tar.gz
+ "
+ KEYWORDS="~amd64"
+fi
+
+LICENSE="GPL-2"
+SLOT="0"
+IUSE="+gui cuda"
+
+DEPEND="
+ gui? ( x11-libs/fltk )
+ cuda? ( dev-util/nvidia-cuda-toolkit )
+ dev-cpp/tbb
+ sci-libs/fftw:3.0
+ media-libs/tiff
+ virtual/mpi
+"
+RDEPEND="
+ ${DEPEND}
+ sci-chemistry/ctffind
+"
+BDEPEND="${DEPEND}"
+
+PATCHES=( "${FILESDIR}/${PN}-4.0.0-build.patch" )
+
+src_unpack() {
+ git-r3_src_unpack
+ default
+}
+
+src_prepare() {
+ cmake_src_prepare
+ mkdir -p "${S}/external/torch_models/"
+ cp "${DISTDIR}/class_ranker_0.1.3_torch_1.0.1.pt.tar.gz" "${S}/external/torch_models/"
+ mkdir -p "${S}/external/torch_models/class_ranker/"
+ cp "${WORKDIR}/class_ranker_0.1.3_torch_1.0.1.pt" "${S}/external/torch_models/class_ranker/"
+ sed -e "s:{CMAKE_INSTALL_PREFIX}/lib:{CMAKE_INSTALL_PREFIX}/$(get_libdir):g" -i CMakeLists.txt || die
+ sed -e "s:LIBRARY DESTINATION lib:LIBRARY DESTINATION $(get_libdir):g" -i src/apps/CMakeLists.txt || die
+}
+
+src_configure() {
+ CMAKE_BUILD_TYPE=Release
+ mycmakeargs=(
+ -DBUILD_SHARED_LIBS=ON
+ -DALTCPU=$(usex !cuda)
+ -DFORCE_OWN_FFTW=OFF
+ -DFORCE_OWN_FLTK=OFF
+ -DFORCE_OWN_TBB=OFF
+ -DCUDA=$(usex cuda)
+ -DGUI=$(usex gui)
+ )
+ cmake_src_configure
+}
diff --git a/sci-chemistry/relion/relion-9999.ebuild b/sci-chemistry/relion/relion-9999.ebuild
new file mode 100644
index 000000000..12e09d2fe
--- /dev/null
+++ b/sci-chemistry/relion/relion-9999.ebuild
@@ -0,0 +1,69 @@
+# Copyright 2019-2021 Gentoo Authors
+# Distributed under the terms of the GNU General Public License v2
+
+EAPI=8
+
+inherit cmake
+
+DESCRIPTION="Image-processing software for cryo-electron microscopy"
+HOMEPAGE="https://www3.mrc-lmb.cam.ac.uk/relion/index.php/Main_Page"
+
+if [[ ${PV} = *9999* ]]; then
+ EGIT_REPO_URI="https://github.com/3dem/relion.git"
+ [[ ${PV} = 9999 ]] && EGIT_BRANCH="master" || EGIT_BRANCH="ver${PV:0:4}"
+ inherit git-r3
+ SRC_URI="ftp://ftp.mrc-lmb.cam.ac.uk/pub/dari/class_ranker_0.1.3_torch_1.0.1.pt.tar.gz"
+else
+ SRC_URI="
+ https://github.com/3dem/relion/archive/${PV}.tar.gz -> ${P}.tar.gz
+ ftp://ftp.mrc-lmb.cam.ac.uk/pub/dari/class_ranker_0.1.3_torch_1.0.1.pt.tar.gz
+ "
+ KEYWORDS="~amd64"
+fi
+
+LICENSE="GPL-2"
+SLOT="0"
+IUSE="+gui cuda"
+
+DEPEND="
+ gui? ( x11-libs/fltk )
+ cuda? ( dev-util/nvidia-cuda-toolkit )
+ dev-cpp/tbb
+ sci-libs/fftw:3.0
+ media-libs/tiff
+ virtual/mpi
+"
+RDEPEND="
+ ${DEPEND}
+ sci-chemistry/ctffind
+"
+BDEPEND="${DEPEND}"
+
+src_unpack() {
+ git-r3_src_unpack
+ default
+}
+
+src_prepare() {
+ cmake_src_prepare
+ mkdir -p "${S}/external/torch_models/"
+ cp "${DISTDIR}/class_ranker_0.1.3_torch_1.0.1.pt.tar.gz" "${S}/external/torch_models/"
+ mkdir -p "${S}/external/torch_models/class_ranker/"
+ cp "${WORKDIR}/class_ranker_0.1.3_torch_1.0.1.pt" "${S}/external/torch_models/class_ranker/"
+ sed -e "s:{CMAKE_INSTALL_PREFIX}/lib:{CMAKE_INSTALL_PREFIX}/$(get_libdir):g" -i CMakeLists.txt || die
+ sed -e "s:LIBRARY DESTINATION lib:LIBRARY DESTINATION $(get_libdir):g" -i src/apps/CMakeLists.txt || die
+}
+
+src_configure() {
+ CMAKE_BUILD_TYPE=Release
+ mycmakeargs=(
+ -DBUILD_SHARED_LIBS=ON
+ -DALTCPU=$(usex !cuda)
+ -DFORCE_OWN_FFTW=OFF
+ -DFORCE_OWN_FLTK=OFF
+ -DFORCE_OWN_TBB=OFF
+ -DCUDA=$(usex cuda)
+ -DGUI=$(usex gui)
+ )
+ cmake_src_configure
+}