diff --git a/sci-biology/cmdock/cmdock-0.2.0-r1.ebuild b/sci-biology/cmdock/cmdock-0.2.0-r2.ebuild similarity index 83% rename from sci-biology/cmdock/cmdock-0.2.0-r1.ebuild rename to sci-biology/cmdock/cmdock-0.2.0-r2.ebuild index f46747447a..55e83bffb6 100644 --- a/sci-biology/cmdock/cmdock-0.2.0-r1.ebuild +++ b/sci-biology/cmdock/cmdock-0.2.0-r2.ebuild @@ -4,7 +4,7 @@ EAPI=8 PYTHON_COMPAT=( python3_{10..12} ) -BOINC_APP_OPTIONAL="true" +BOINC_APP_OPTIONAL=1 inherit boinc-app flag-o-matic meson optfeature python-any-r1 DESCRIPTION="Program for docking ligands to proteins and nucleic acids" @@ -15,14 +15,11 @@ S="${WORKDIR}/${PN}-v${PV}" LICENSE="LGPL-3 ZLIB" SLOT="0/${PV}" KEYWORDS="~amd64" -IUSE="apidoc boinc cpu_flags_x86_sse2 doc test" +IUSE="apidoc cpu_flags_x86_sse2 doc test" # Flaky tests RESTRICT="test" -RDEPEND=" - boinc? ( sci-misc/boinc-wrapper ) -" DEPEND=" dev-cpp/eigen:3 >=dev-cpp/indicators-2.3-r1 @@ -58,6 +55,8 @@ is to attach it to SiDock@home BOINC project." INSTALL_PREFIX="${EPREFIX}/opt/${P}" +boinc-app_add_deps + python_check_deps() { use doc || return 0 @@ -77,7 +76,7 @@ src_prepare() { src_configure() { # very weird directory layout local emesonargs=( - --prefix="${INSTALL_PREFIX}" + --prefix="${INSTALL_PREFIX:?}" $(meson_use apidoc) $(meson_use doc) $(meson_use test tests) @@ -90,22 +89,22 @@ src_configure() { src_install() { meson_src_install - python_optimize "${D}${INSTALL_PREFIX}"/bin + python_optimize "${D}${INSTALL_PREFIX:?}"/bin if use boinc; then - doappinfo "${FILESDIR}"/app_info_${PV}.xml - dowrapper cmdock-l + boinc_install_appinfo "${FILESDIR}"/app_info_0.2.0-r1.xml + boinc_install_wrapper cmdock-l_wrapper \ + "${FILESDIR}"/cmdock-l_job_0.2.0-r1.xml cmdock-l_job.xml # install cmdock executable exeinto "$(get_project_root)" exeopts --owner root --group boinc - newexe "${D}${INSTALL_PREFIX}"/bin/cmdock cmdock-${PV} + doexe "${D}${INSTALL_PREFIX:?}"/bin/cmdock # install a blank file - touch "${T}"/docking_out || die insinto "$(get_project_root)" - insopts --owner root --group boinc - doins "${T}"/docking_out + insopts -m 0644 --owner root --group boinc + newins - docking_out fi } diff --git a/sci-biology/cmdock/files/app_info_0.2.0.xml b/sci-biology/cmdock/files/app_info_0.2.0-r1.xml similarity index 68% rename from sci-biology/cmdock/files/app_info_0.2.0.xml rename to sci-biology/cmdock/files/app_info_0.2.0-r1.xml index ad23f78901..b9eb040fbd 100644 --- a/sci-biology/cmdock/files/app_info_0.2.0.xml +++ b/sci-biology/cmdock/files/app_info_0.2.0-r1.xml @@ -1,22 +1,22 @@ cmdock-l - CurieMarieDock 0.2.0 long tasks + CurieMarieDock @PV@ long tasks - cmdock-l_wrapper_@PV@ + cmdock-l_wrapper - cmdock-@PV@ + cmdock - cmdock-l_job_@PV@.xml + cmdock-l_job.xml @@ -28,16 +28,16 @@ cmdock-l 100 - cmdock-l_wrapper_@PV@ + cmdock-l_wrapper - cmdock-@PV@ + cmdock cmdock - cmdock-l_job_@PV@.xml + cmdock-l_job.xml job.xml diff --git a/sci-biology/cmdock/files/cmdock-l_job_0.2.0.xml b/sci-biology/cmdock/files/cmdock-l_job_0.2.0-r1.xml similarity index 77% rename from sci-biology/cmdock/files/cmdock-l_job_0.2.0.xml rename to sci-biology/cmdock/files/cmdock-l_job_0.2.0-r1.xml index a163eb29cf..6d626fb826 100644 --- a/sci-biology/cmdock/files/cmdock-l_job_0.2.0.xml +++ b/sci-biology/cmdock/files/cmdock-l_job_0.2.0-r1.xml @@ -2,7 +2,7 @@ cmdock docking_log - -c -j 1 -b 1 -x -r target.prm -p "@PREFIX@/data/scripts/dock.prm" -f htvs.ptc -i ligands.sdf -o docking_out + -c -j 1 -b 1 -r target.prm -p "@PREFIX@/data/scripts/dock.prm" -f htvs.ptc -i ligands.sdf -o docking_out docking_out.chk docking_out.progress CMDOCK_ROOT=@PREFIX@