diff options
Diffstat (limited to 'sci-chemistry/hoomd')
| -rw-r--r-- | sci-chemistry/hoomd/ChangeLog | 8 | ||||
| -rw-r--r-- | sci-chemistry/hoomd/Manifest | 6 | ||||
| -rw-r--r-- | sci-chemistry/hoomd/hoomd-0.9.1.3815.ebuild | 113 | ||||
| -rw-r--r-- | sci-chemistry/hoomd/metadata.xml | 10 |
4 files changed, 137 insertions, 0 deletions
diff --git a/sci-chemistry/hoomd/ChangeLog b/sci-chemistry/hoomd/ChangeLog new file mode 100644 index 000000000..31f9037bb --- /dev/null +++ b/sci-chemistry/hoomd/ChangeLog @@ -0,0 +1,8 @@ +# ChangeLog for sci-chemistry/hoomd +# Copyright 1999-2011 Gentoo Foundation; Distributed under the GPL v2 +# $Header: $ + + 13 Mar 2011; Ross Smith (gaurdro) <gaurdro@gmail.com> + +hoomd-0.9.1.3815.ebuild, +metadata.xml: + New Ebuild for bug 357021. Thanks to the sunrise devs for their help + diff --git a/sci-chemistry/hoomd/Manifest b/sci-chemistry/hoomd/Manifest new file mode 100644 index 000000000..1d8c1e3d9 --- /dev/null +++ b/sci-chemistry/hoomd/Manifest @@ -0,0 +1,6 @@ +DIST hoomd-0.9.1.3815.tar.bz2 4631180 RMD160 ba2f16ae7802a8c612fd44cd353bccd1b5249d1a SHA1 4dff6182b6c423627bb5f3d2f434aab1f05fd4f3 SHA256 14ba3e17494681275593f7beafbe11dd84a954aa737f37807671ea70f7c8f3be +DIST hoomd-devdoc-0.9.1.tar.bz2 729365 RMD160 e214c7351adbf32d7512ca8f9d0d7d2bc8753403 SHA1 511eb112d28297c0e0a0d3c4525934c54bc704ef SHA256 e2d5fcad50c94b7a7eea1b7142f4d0c7590a014587e6c8978c74e81580b8e57e +DIST hoomd-userdoc-0.9.1.pdf 1462069 RMD160 db125732309cbdc85f6233fbefb246158a257820 SHA1 395439b3377d275b974831b00067ac046e94ab25 SHA256 119d97d630df30683debf4e128b3b4692bb3926b14ada3d4da7117a8c1086b09 +EBUILD hoomd-0.9.1.3815.ebuild 3299 RMD160 9f731174bfd60e46750837b024f036e070b70b51 SHA1 6a26156faf3da5dec0e8303fa0f6f5f597ecd418 SHA256 5615c737e2841a516c6a9d652d2bfdf771a57841a86edd75ffe1874b8a33cd37 +MISC ChangeLog 292 RMD160 70af3643d24e3fcd3a6139d056bf270d179afcbb SHA1 9df582916111fd3c69eede3906afdf9877c0bcba SHA256 91bd835482bb94b70d903df4d79861eaad8bd9d871c5a48e02102f808fb9f12e +MISC metadata.xml 519 RMD160 9d8f1a598d95942c3832bb3f37c1cf15bde68bfa SHA1 3b646121e743776d9c2f7d5762cec79d67cdae16 SHA256 0274214dbdc5912f598acd525ebb28d0c54c01b23d21182bb31e12bb1e09c7b0 diff --git a/sci-chemistry/hoomd/hoomd-0.9.1.3815.ebuild b/sci-chemistry/hoomd/hoomd-0.9.1.3815.ebuild new file mode 100644 index 000000000..94a7d7e9c --- /dev/null +++ b/sci-chemistry/hoomd/hoomd-0.9.1.3815.ebuild @@ -0,0 +1,113 @@ +# Copyright 1999-2011 Gentoo Foundation +# Distributed under the terms of the GNU General Public License v2 +# $Header: $ + +EAPI="2" +PYTHON_DEPEND="2" +SUPPORT_PYTHON_ABIS="1" +MY_DOC_PV="0.9.1" + +inherit cmake-utils eutils fdo-mime python versionator +DESCRIPTION="HOOMD performs general purpose molecular dynamics simulations on NVIDIA GPUs" +HOMEPAGE="http://codeblue.umich.edu/hoomd-blue/index.html" +SRC_URI="http://umich.edu/~rjsm/${P}.tar.bz2 + doc? ( http://codeblue.umich.edu/hoomd-blue/downloads/0.9/hoomd-userdoc-${MY_DOC_PV}.pdf + http://codeblue.umich.edu/hoomd-blue/downloads/0.9/hoomd-devdoc-${MY_DOC_PV}.tar.bz2 )" + +LICENSE="BSD" +SLOT="0" +KEYWORDS="~amd64 ~x86" +IUSE="+cuda debug doc +openmp +single-precision static-libs zlib" + +RDEPEND="dev-libs/boost + cuda? ( >=dev-util/nvidia-cuda-toolkit-2.0 dev-util/nvidia-cuda-sdk ) + sys-libs/zlib" +DEPEND="${RDEPEND}" +RESTRICT_PYTHON_ABIS="3.*" + +pkg_setup() { + python_pkg_setup + + if use cuda && version_is_at_least 4.5 $(gcc-version) \ + && has_version <=nvidia-cuda-toolkit-3.2 \ + && has_version >nvidia-cuda-toolkit-3.0; then + ewarn "Nvidia CUDA SDK Version 3.2 and below require a gcc version less than 4.5" + ewarn "Enabling the cuda use flag with gcc version 4.5 or higher will cause build failures in those SDK versions." + ewarn "Please use gcc-config to set a gcc version less than 4.5." + fi + + if use cuda && version_is_at_least 4.4 $(gcc-version) \ + && has_version <=nvidia-cuda-toolkit-3.0; then + ewarn "Nvidia CUDA SDK version 3.0 and below requires a gcc version less than 4.4" + ewarn "Enabling the cuda use flag with gcc version 4.4 or higher will cause build failures in those SDK versions." + ewarn "Please use gcc-config to set a gcc version less than 4.4 ." + fi + +} + +src_unpack() { + unpack ${P}.tar.bz2 + use doc && unpack hoomd-devdoc-${PV}.tar.bz2 +} + +src_prepare(){ + python_copy_sources +} + +src_configure(){ + use single-precision && local sp="ON" || local sp="OFF" + + if use !single-precision && use cuda ; then + ewarn "Single precision must be enabled to have cuda support built-in." + ewarn "Single-precision will be enabled for this build." + local sp="ON" + fi + my_config() { + local mycmakeargs=( + $(cmake-utils_use_enable cuda CUDA) + $(cmake-utils_use_enable static-lib STATIC) + $(cmake-utils_use_enable test BUILD_TESTING) + $(cmake-utils_use_enable openmp OPENMP) + $(cmake-utils_use_enable zlib ZLIB) + -DENABLE_VALGRIND=OFF + -DENABLE_NATIVE_INSTALL=0N + -DENABLE_DOXYGEN=OFF + -DPYTHON_SITEDIR=$(python_get_sitedir) + -DENABLE_SINGLE_PRECISION=${sp} + -DCMAKE_BUILD_TYPE=${cbt} + -DENABLE_OCELOT:BOOL=OFF + ) + + cmake-utils_src_configure + } + + python_execute_function -s my_config +} + +src_test(){ + python_execute_function -s cmake-utils_src_test +} + +src_install(){ + if use doc; then + + insinto /usr/share/doc/${PF} + newins "${DISTDIR}/hoomd-userdoc-${MY_DOC_PV}.pdf" hoom-userdoc-${PV}.pdf || die "docs failed" + + insinto /usr/share/doc/${PF}/devdocs + mv "hoomd-devdoc-${MY_DOC_PV}/" "hoomd-devdoc-${PV}" || die + doins -r "hoomd-devdoc-${PV}/" || die "docs failed" + fi + + python_execute_function -s cmake-utils_src_install +} + +pkg_postinst() { + fdo-mime_desktop_database_update + fdo-mime_mime_database_update +} + +pkg_postrm() { + fdo-mime_desktop_database_update + fdo-mime_mime_database_update +} diff --git a/sci-chemistry/hoomd/metadata.xml b/sci-chemistry/hoomd/metadata.xml new file mode 100644 index 000000000..e45e3ac1f --- /dev/null +++ b/sci-chemistry/hoomd/metadata.xml @@ -0,0 +1,10 @@ +<?xml version="1.0" encoding="UTF-8"?> +<!DOCTYPE pkgmetadata SYSTEM "http://www.gentoo.org/dtd/metadata.dtd"> +<pkgmetadata> + <herd>no-herd</herd> + <maintainer><email>maintainer-wanted@gentoo.org</email></maintainer> +<use> + <flag name='cuda'>Enables support for the NVIDIA CUDA library. Requires single-precision flag be set.</flag> + <flag name='single-precision'>Computations will be performed using single precision numbers. Otherwise computations will be performed in double precision. </flag> +</use> +</pkgmetadata> |