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commit: f22d15b68f957f56234b30a20e8a77b74cc5a40a |
| 2 |
Author: Justin Lecher <jlec <AT> gentoo <DOT> org> |
| 3 |
AuthorDate: Sat Dec 28 23:52:44 2013 +0000 |
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Commit: Justin Lecher <jlec <AT> gentoo <DOT> org> |
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CommitDate: Sat Dec 28 23:52:44 2013 +0000 |
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URL: http://git.overlays.gentoo.org/gitweb/?p=proj/sci.git;a=commit;h=f22d15b6 |
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|
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More up to date version in tree |
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|
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Signed-off-by: Justin Lecher <jlec <AT> gentoo.org> |
| 11 |
|
| 12 |
--- |
| 13 |
sci-physics/lammps/ChangeLog | 77 -------------------- |
| 14 |
sci-physics/lammps/lammps-20130816.ebuild | 114 ------------------------------ |
| 15 |
sci-physics/lammps/lammps-20130830.ebuild | 114 ------------------------------ |
| 16 |
sci-physics/lammps/lammps-20130917.ebuild | 114 ------------------------------ |
| 17 |
sci-physics/lammps/lammps-20130923.ebuild | 114 ------------------------------ |
| 18 |
sci-physics/lammps/lammps-20130930.ebuild | 114 ------------------------------ |
| 19 |
sci-physics/lammps/lammps-20131111.ebuild | 114 ------------------------------ |
| 20 |
sci-physics/lammps/lammps-20131123.ebuild | 114 ------------------------------ |
| 21 |
sci-physics/lammps/lammps-20131201.ebuild | 114 ------------------------------ |
| 22 |
sci-physics/lammps/metadata.xml | 31 -------- |
| 23 |
10 files changed, 1020 deletions(-) |
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|
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diff --git a/sci-physics/lammps/ChangeLog b/sci-physics/lammps/ChangeLog |
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deleted file mode 100644 |
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index 76ef3a9..0000000 |
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--- a/sci-physics/lammps/ChangeLog |
| 29 |
+++ /dev/null |
| 30 |
@@ -1,77 +0,0 @@ |
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-# ChangeLog for sci-physics/lammps |
| 32 |
-# Copyright 1999-2013 Gentoo Foundation; Distributed under the GPL v2 |
| 33 |
-# $Header: $ |
| 34 |
- |
| 35 |
- 22 Dec 2013; Christoph Junghans <ottxor@g.o> lammps-20130816.ebuild, |
| 36 |
- lammps-20130830.ebuild, lammps-20130917.ebuild, lammps-20130923.ebuild, |
| 37 |
- lammps-20130930.ebuild, lammps-20131111.ebuild, lammps-20131123.ebuild, |
| 38 |
- lammps-20131201.ebuild: |
| 39 |
- remove elog message |
| 40 |
- |
| 41 |
- 13 Dec 2013; Nicolas Bock <nicolasbock@g.o> metadata.xml: |
| 42 |
- sci-physics/lammps: updated maintainer email to gentoo.org |
| 43 |
- |
| 44 |
-*lammps-20131201 (04 Dec 2013) |
| 45 |
- |
| 46 |
- 04 Dec 2013; Nicolas Bock <nicolasbock@×××××.com> +lammps-20131201.ebuild: |
| 47 |
- sci-physics/lammps: Version bump to 20121201. |
| 48 |
- |
| 49 |
-*lammps-20131123 (22 Nov 2013) |
| 50 |
- |
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- 22 Nov 2013; Nicolas Bock <nicolasbock@×××××.com> +lammps-20131123.ebuild: |
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- sci-physics/lammps-20131123: Version bump. |
| 53 |
- |
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-*lammps-20131111 (11 Nov 2013) |
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- |
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- 11 Nov 2013; Nicolas Bock <nicolasbock@×××××.com> +lammps-20131111.ebuild: |
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- sci-physics/lammps-20131111: Version bump. |
| 58 |
- |
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-*lammps-20130930 (16 Oct 2013) |
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- |
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- 16 Oct 2013; Nicolas Bock <nicolasbock@×××××.com> +lammps-20130930.ebuild: |
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- sci-physics/lammps-20130930: Version bump. |
| 63 |
- |
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-*lammps-20130923 (27 Sep 2013) |
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- |
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- 27 Sep 2013; Nicolas Bock <nicolasbock@×××××.com> +lammps-20130923.ebuild, |
| 67 |
- -lammps-20130701.ebuild, -lammps-20130708.ebuild, -lammps-20130711.ebuild: |
| 68 |
- sci-physics/lammps-20130923: Version bump. I also removed older versions to |
| 69 |
- clean up a bit. |
| 70 |
- |
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-*lammps-20130917 (18 Sep 2013) |
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- |
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- 18 Sep 2013; Nicolas Bock <nicolasbock@×××××.com> +lammps-20130917.ebuild: |
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- sci-physics/lammps-20130917: Version bump. |
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- |
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-*lammps-20130830 (02 Sep 2013) |
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- |
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- 02 Sep 2013; Nicolas Bock <nicolasbock@×××××.com> +lammps-20130830.ebuild: |
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- sci-physics/lammps: Version bump to 20130830. |
| 80 |
- |
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-*lammps-20130816 (13 Aug 2013) |
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- |
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- 13 Aug 2013; Nicolas Bock <nicolasbock@×××××.com> +lammps-20130816.ebuild: |
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- sci-physics/lammps-20130816: Version bump. |
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- |
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-*lammps-20130711 (16 Jul 2013) |
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- |
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- 16 Jul 2013; Nicolas Bock <nicolasbock@×××××.com> +lammps-20130711.ebuild: |
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- Version bump to sci-physics/lammps-20130711 |
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- |
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- 09 Jul 2013; Nicolas Bock <nicolasbock@×××××.com> lammps-20130708.ebuild: |
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- sci-physics/lammps: Fixed repoman warning. |
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- |
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-*lammps-20130708 (09 Jul 2013) |
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- |
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- 09 Jul 2013; Nicolas Bock <nicolasbock@×××××.com> +lammps-20130708.ebuild: |
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- Added current version: sci-physics/lammps-20130708. * Fixed bug in lammps to |
| 98 |
- gentoo version string conversion. In bash arithmetic operations, a string |
| 99 |
- literal with a leading "0" is interpreted in base 8. * Added potentials, which |
| 100 |
- were not installed in previous versions. * Moved examples from |
| 101 |
- /usr/share/doc/${PF} to /usr/share/lammps-${PF}. |
| 102 |
- |
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-*lammps-20130701 (03 Jul 2013) |
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- |
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- 03 Jul 2013; Nicolas Bock <nicolasbock@×××××.com> +lammps-20130701.ebuild, |
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- +metadata.xml: |
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- Version bump to 1-Jul-2013. |
| 108 |
|
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diff --git a/sci-physics/lammps/lammps-20130816.ebuild b/sci-physics/lammps/lammps-20130816.ebuild |
| 110 |
deleted file mode 100644 |
| 111 |
index 93a69ed..0000000 |
| 112 |
--- a/sci-physics/lammps/lammps-20130816.ebuild |
| 113 |
+++ /dev/null |
| 114 |
@@ -1,114 +0,0 @@ |
| 115 |
-# Copyright 1999-2013 Gentoo Foundation |
| 116 |
-# Distributed under the terms of the GNU General Public License v2 |
| 117 |
-# $Header: /var/cvsroot/gentoo-x86/sci-physics/lammps/lammps-20130526.ebuild,v 1.1 2013/06/26 23:53:11 ottxor Exp $ |
| 118 |
- |
| 119 |
-EAPI=5 |
| 120 |
- |
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-FORTRAN_NEEDED="package-meam" |
| 122 |
- |
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-inherit eutils fortran-2 |
| 124 |
- |
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-convert_month() { |
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- case $1 in |
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- 01) echo Jan |
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- ;; |
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- 02) echo Feb |
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- ;; |
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- 03) echo Mar |
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- ;; |
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- 04) echo Apr |
| 134 |
- ;; |
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- 05) echo May |
| 136 |
- ;; |
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- 06) echo Jun |
| 138 |
- ;; |
| 139 |
- 07) echo Jul |
| 140 |
- ;; |
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- 08) echo Aug |
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- ;; |
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- 09) echo Sep |
| 144 |
- ;; |
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- 10) echo Oct |
| 146 |
- ;; |
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- 11) echo Nov |
| 148 |
- ;; |
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- 12) echo Dec |
| 150 |
- ;; |
| 151 |
- *) echo unknown |
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- ;; |
| 153 |
- esac |
| 154 |
-} |
| 155 |
- |
| 156 |
-MY_P=${PN}-$((10#${PV:6:2}))$(convert_month ${PV:4:2})${PV:2:2} |
| 157 |
- |
| 158 |
-DESCRIPTION="Large-scale Atomic/Molecular Massively Parallel Simulator" |
| 159 |
-HOMEPAGE="http://lammps.sandia.gov/" |
| 160 |
-SRC_URI="http://lammps.sandia.gov/tars/${MY_P}.tar.gz" |
| 161 |
- |
| 162 |
-LICENSE="GPL-2" |
| 163 |
-SLOT="0" |
| 164 |
-KEYWORDS="~amd64" |
| 165 |
-IUSE="doc examples gzip lammps-memalign mpi package-dipole package-meam package-rigid" |
| 166 |
- |
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-DEPEND="mpi? ( virtual/mpi )" |
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-RDEPEND="${DEPEND}" |
| 169 |
- |
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-S="${WORKDIR}/${MY_P}" |
| 171 |
- |
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-lmp_emake() { |
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- local LAMMPS_INCLUDEFLAGS="$(usex gzip '-DLAMMPS_GZIP' '')" |
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- LAMMPS_INCLUDEFLAGS+="$(usex lammps-memalign ' -DLAMMPS_MEMALIGN' '')" |
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- |
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- # Note: The lammps makefile uses CC to indicate the C++ compiler. |
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- emake \ |
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- ARCHIVE=$(tc-getAR) \ |
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- CC=$(usex mpi "mpic++" "$(tc-getCXX)") \ |
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- F90=$(usex mpi "mpif90" "$(tc-getFC)") \ |
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- LINK=$(usex mpi "mpic++" "$(tc-getCXX)") \ |
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- CCFLAGS="${CXXFLAGS}" \ |
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- F90FLAGS="${FCFLAGS}" \ |
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- LINKFLAGS="${LDFLAGS}" \ |
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- LMP_INC="${LAMMPS_INCLUDEFLAGS}" \ |
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- MPI_INC=$(usex mpi '' "-I../STUBS") \ |
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- MPI_PATH=$(usex mpi '' '-L../STUBS') \ |
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- MPI_LIB=$(usex mpi '' '-lmpi_stubs') \ |
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- "$@" |
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-} |
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- |
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-src_compile() { |
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- # Compile stubs for serial version. |
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- use mpi || lmp_emake -C src stubs |
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- |
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- # Build optional packages. |
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- if use package-meam; then |
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- lmp_emake -C src yes-meam |
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- lmp_emake -j1 -C lib/meam -f Makefile.gfortran |
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- fi |
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- use package-dipole && emake -C src yes-dipole |
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- use package-rigid && emake -C src yes-rigid |
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- |
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- # Compile. |
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- lmp_emake -C src serial |
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-} |
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- |
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-src_install() { |
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- newbin "src/lmp_serial" "lmp" |
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- |
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- local LAMMPS_POTENTIALS="/usr/share/${PF}/potentials" |
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- insinto "${LAMMPS_POTENTIALS}" |
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- doins potentials/* |
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- echo "LAMMPS_POTENTIALS=${LAMMPS_POTENTIALS}" > 99lammps |
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- doenvd 99lammps |
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- |
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- if use examples; then |
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- local LAMMPS_EXAMPLES="/usr/share/${PF}/examples" |
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- insinto "${LAMMPS_EXAMPLES}" |
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- doins -r examples/* |
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- fi |
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- |
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- dodoc README |
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- if use doc; then |
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- dodoc doc/Manual.pdf |
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- dohtml -r doc/* |
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- fi |
| 228 |
-} |
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|
| 230 |
diff --git a/sci-physics/lammps/lammps-20130830.ebuild b/sci-physics/lammps/lammps-20130830.ebuild |
| 231 |
deleted file mode 100644 |
| 232 |
index 93a69ed..0000000 |
| 233 |
--- a/sci-physics/lammps/lammps-20130830.ebuild |
| 234 |
+++ /dev/null |
| 235 |
@@ -1,114 +0,0 @@ |
| 236 |
-# Copyright 1999-2013 Gentoo Foundation |
| 237 |
-# Distributed under the terms of the GNU General Public License v2 |
| 238 |
-# $Header: /var/cvsroot/gentoo-x86/sci-physics/lammps/lammps-20130526.ebuild,v 1.1 2013/06/26 23:53:11 ottxor Exp $ |
| 239 |
- |
| 240 |
-EAPI=5 |
| 241 |
- |
| 242 |
-FORTRAN_NEEDED="package-meam" |
| 243 |
- |
| 244 |
-inherit eutils fortran-2 |
| 245 |
- |
| 246 |
-convert_month() { |
| 247 |
- case $1 in |
| 248 |
- 01) echo Jan |
| 249 |
- ;; |
| 250 |
- 02) echo Feb |
| 251 |
- ;; |
| 252 |
- 03) echo Mar |
| 253 |
- ;; |
| 254 |
- 04) echo Apr |
| 255 |
- ;; |
| 256 |
- 05) echo May |
| 257 |
- ;; |
| 258 |
- 06) echo Jun |
| 259 |
- ;; |
| 260 |
- 07) echo Jul |
| 261 |
- ;; |
| 262 |
- 08) echo Aug |
| 263 |
- ;; |
| 264 |
- 09) echo Sep |
| 265 |
- ;; |
| 266 |
- 10) echo Oct |
| 267 |
- ;; |
| 268 |
- 11) echo Nov |
| 269 |
- ;; |
| 270 |
- 12) echo Dec |
| 271 |
- ;; |
| 272 |
- *) echo unknown |
| 273 |
- ;; |
| 274 |
- esac |
| 275 |
-} |
| 276 |
- |
| 277 |
-MY_P=${PN}-$((10#${PV:6:2}))$(convert_month ${PV:4:2})${PV:2:2} |
| 278 |
- |
| 279 |
-DESCRIPTION="Large-scale Atomic/Molecular Massively Parallel Simulator" |
| 280 |
-HOMEPAGE="http://lammps.sandia.gov/" |
| 281 |
-SRC_URI="http://lammps.sandia.gov/tars/${MY_P}.tar.gz" |
| 282 |
- |
| 283 |
-LICENSE="GPL-2" |
| 284 |
-SLOT="0" |
| 285 |
-KEYWORDS="~amd64" |
| 286 |
-IUSE="doc examples gzip lammps-memalign mpi package-dipole package-meam package-rigid" |
| 287 |
- |
| 288 |
-DEPEND="mpi? ( virtual/mpi )" |
| 289 |
-RDEPEND="${DEPEND}" |
| 290 |
- |
| 291 |
-S="${WORKDIR}/${MY_P}" |
| 292 |
- |
| 293 |
-lmp_emake() { |
| 294 |
- local LAMMPS_INCLUDEFLAGS="$(usex gzip '-DLAMMPS_GZIP' '')" |
| 295 |
- LAMMPS_INCLUDEFLAGS+="$(usex lammps-memalign ' -DLAMMPS_MEMALIGN' '')" |
| 296 |
- |
| 297 |
- # Note: The lammps makefile uses CC to indicate the C++ compiler. |
| 298 |
- emake \ |
| 299 |
- ARCHIVE=$(tc-getAR) \ |
| 300 |
- CC=$(usex mpi "mpic++" "$(tc-getCXX)") \ |
| 301 |
- F90=$(usex mpi "mpif90" "$(tc-getFC)") \ |
| 302 |
- LINK=$(usex mpi "mpic++" "$(tc-getCXX)") \ |
| 303 |
- CCFLAGS="${CXXFLAGS}" \ |
| 304 |
- F90FLAGS="${FCFLAGS}" \ |
| 305 |
- LINKFLAGS="${LDFLAGS}" \ |
| 306 |
- LMP_INC="${LAMMPS_INCLUDEFLAGS}" \ |
| 307 |
- MPI_INC=$(usex mpi '' "-I../STUBS") \ |
| 308 |
- MPI_PATH=$(usex mpi '' '-L../STUBS') \ |
| 309 |
- MPI_LIB=$(usex mpi '' '-lmpi_stubs') \ |
| 310 |
- "$@" |
| 311 |
-} |
| 312 |
- |
| 313 |
-src_compile() { |
| 314 |
- # Compile stubs for serial version. |
| 315 |
- use mpi || lmp_emake -C src stubs |
| 316 |
- |
| 317 |
- # Build optional packages. |
| 318 |
- if use package-meam; then |
| 319 |
- lmp_emake -C src yes-meam |
| 320 |
- lmp_emake -j1 -C lib/meam -f Makefile.gfortran |
| 321 |
- fi |
| 322 |
- use package-dipole && emake -C src yes-dipole |
| 323 |
- use package-rigid && emake -C src yes-rigid |
| 324 |
- |
| 325 |
- # Compile. |
| 326 |
- lmp_emake -C src serial |
| 327 |
-} |
| 328 |
- |
| 329 |
-src_install() { |
| 330 |
- newbin "src/lmp_serial" "lmp" |
| 331 |
- |
| 332 |
- local LAMMPS_POTENTIALS="/usr/share/${PF}/potentials" |
| 333 |
- insinto "${LAMMPS_POTENTIALS}" |
| 334 |
- doins potentials/* |
| 335 |
- echo "LAMMPS_POTENTIALS=${LAMMPS_POTENTIALS}" > 99lammps |
| 336 |
- doenvd 99lammps |
| 337 |
- |
| 338 |
- if use examples; then |
| 339 |
- local LAMMPS_EXAMPLES="/usr/share/${PF}/examples" |
| 340 |
- insinto "${LAMMPS_EXAMPLES}" |
| 341 |
- doins -r examples/* |
| 342 |
- fi |
| 343 |
- |
| 344 |
- dodoc README |
| 345 |
- if use doc; then |
| 346 |
- dodoc doc/Manual.pdf |
| 347 |
- dohtml -r doc/* |
| 348 |
- fi |
| 349 |
-} |
| 350 |
|
| 351 |
diff --git a/sci-physics/lammps/lammps-20130917.ebuild b/sci-physics/lammps/lammps-20130917.ebuild |
| 352 |
deleted file mode 100644 |
| 353 |
index 93a69ed..0000000 |
| 354 |
--- a/sci-physics/lammps/lammps-20130917.ebuild |
| 355 |
+++ /dev/null |
| 356 |
@@ -1,114 +0,0 @@ |
| 357 |
-# Copyright 1999-2013 Gentoo Foundation |
| 358 |
-# Distributed under the terms of the GNU General Public License v2 |
| 359 |
-# $Header: /var/cvsroot/gentoo-x86/sci-physics/lammps/lammps-20130526.ebuild,v 1.1 2013/06/26 23:53:11 ottxor Exp $ |
| 360 |
- |
| 361 |
-EAPI=5 |
| 362 |
- |
| 363 |
-FORTRAN_NEEDED="package-meam" |
| 364 |
- |
| 365 |
-inherit eutils fortran-2 |
| 366 |
- |
| 367 |
-convert_month() { |
| 368 |
- case $1 in |
| 369 |
- 01) echo Jan |
| 370 |
- ;; |
| 371 |
- 02) echo Feb |
| 372 |
- ;; |
| 373 |
- 03) echo Mar |
| 374 |
- ;; |
| 375 |
- 04) echo Apr |
| 376 |
- ;; |
| 377 |
- 05) echo May |
| 378 |
- ;; |
| 379 |
- 06) echo Jun |
| 380 |
- ;; |
| 381 |
- 07) echo Jul |
| 382 |
- ;; |
| 383 |
- 08) echo Aug |
| 384 |
- ;; |
| 385 |
- 09) echo Sep |
| 386 |
- ;; |
| 387 |
- 10) echo Oct |
| 388 |
- ;; |
| 389 |
- 11) echo Nov |
| 390 |
- ;; |
| 391 |
- 12) echo Dec |
| 392 |
- ;; |
| 393 |
- *) echo unknown |
| 394 |
- ;; |
| 395 |
- esac |
| 396 |
-} |
| 397 |
- |
| 398 |
-MY_P=${PN}-$((10#${PV:6:2}))$(convert_month ${PV:4:2})${PV:2:2} |
| 399 |
- |
| 400 |
-DESCRIPTION="Large-scale Atomic/Molecular Massively Parallel Simulator" |
| 401 |
-HOMEPAGE="http://lammps.sandia.gov/" |
| 402 |
-SRC_URI="http://lammps.sandia.gov/tars/${MY_P}.tar.gz" |
| 403 |
- |
| 404 |
-LICENSE="GPL-2" |
| 405 |
-SLOT="0" |
| 406 |
-KEYWORDS="~amd64" |
| 407 |
-IUSE="doc examples gzip lammps-memalign mpi package-dipole package-meam package-rigid" |
| 408 |
- |
| 409 |
-DEPEND="mpi? ( virtual/mpi )" |
| 410 |
-RDEPEND="${DEPEND}" |
| 411 |
- |
| 412 |
-S="${WORKDIR}/${MY_P}" |
| 413 |
- |
| 414 |
-lmp_emake() { |
| 415 |
- local LAMMPS_INCLUDEFLAGS="$(usex gzip '-DLAMMPS_GZIP' '')" |
| 416 |
- LAMMPS_INCLUDEFLAGS+="$(usex lammps-memalign ' -DLAMMPS_MEMALIGN' '')" |
| 417 |
- |
| 418 |
- # Note: The lammps makefile uses CC to indicate the C++ compiler. |
| 419 |
- emake \ |
| 420 |
- ARCHIVE=$(tc-getAR) \ |
| 421 |
- CC=$(usex mpi "mpic++" "$(tc-getCXX)") \ |
| 422 |
- F90=$(usex mpi "mpif90" "$(tc-getFC)") \ |
| 423 |
- LINK=$(usex mpi "mpic++" "$(tc-getCXX)") \ |
| 424 |
- CCFLAGS="${CXXFLAGS}" \ |
| 425 |
- F90FLAGS="${FCFLAGS}" \ |
| 426 |
- LINKFLAGS="${LDFLAGS}" \ |
| 427 |
- LMP_INC="${LAMMPS_INCLUDEFLAGS}" \ |
| 428 |
- MPI_INC=$(usex mpi '' "-I../STUBS") \ |
| 429 |
- MPI_PATH=$(usex mpi '' '-L../STUBS') \ |
| 430 |
- MPI_LIB=$(usex mpi '' '-lmpi_stubs') \ |
| 431 |
- "$@" |
| 432 |
-} |
| 433 |
- |
| 434 |
-src_compile() { |
| 435 |
- # Compile stubs for serial version. |
| 436 |
- use mpi || lmp_emake -C src stubs |
| 437 |
- |
| 438 |
- # Build optional packages. |
| 439 |
- if use package-meam; then |
| 440 |
- lmp_emake -C src yes-meam |
| 441 |
- lmp_emake -j1 -C lib/meam -f Makefile.gfortran |
| 442 |
- fi |
| 443 |
- use package-dipole && emake -C src yes-dipole |
| 444 |
- use package-rigid && emake -C src yes-rigid |
| 445 |
- |
| 446 |
- # Compile. |
| 447 |
- lmp_emake -C src serial |
| 448 |
-} |
| 449 |
- |
| 450 |
-src_install() { |
| 451 |
- newbin "src/lmp_serial" "lmp" |
| 452 |
- |
| 453 |
- local LAMMPS_POTENTIALS="/usr/share/${PF}/potentials" |
| 454 |
- insinto "${LAMMPS_POTENTIALS}" |
| 455 |
- doins potentials/* |
| 456 |
- echo "LAMMPS_POTENTIALS=${LAMMPS_POTENTIALS}" > 99lammps |
| 457 |
- doenvd 99lammps |
| 458 |
- |
| 459 |
- if use examples; then |
| 460 |
- local LAMMPS_EXAMPLES="/usr/share/${PF}/examples" |
| 461 |
- insinto "${LAMMPS_EXAMPLES}" |
| 462 |
- doins -r examples/* |
| 463 |
- fi |
| 464 |
- |
| 465 |
- dodoc README |
| 466 |
- if use doc; then |
| 467 |
- dodoc doc/Manual.pdf |
| 468 |
- dohtml -r doc/* |
| 469 |
- fi |
| 470 |
-} |
| 471 |
|
| 472 |
diff --git a/sci-physics/lammps/lammps-20130923.ebuild b/sci-physics/lammps/lammps-20130923.ebuild |
| 473 |
deleted file mode 100644 |
| 474 |
index 93a69ed..0000000 |
| 475 |
--- a/sci-physics/lammps/lammps-20130923.ebuild |
| 476 |
+++ /dev/null |
| 477 |
@@ -1,114 +0,0 @@ |
| 478 |
-# Copyright 1999-2013 Gentoo Foundation |
| 479 |
-# Distributed under the terms of the GNU General Public License v2 |
| 480 |
-# $Header: /var/cvsroot/gentoo-x86/sci-physics/lammps/lammps-20130526.ebuild,v 1.1 2013/06/26 23:53:11 ottxor Exp $ |
| 481 |
- |
| 482 |
-EAPI=5 |
| 483 |
- |
| 484 |
-FORTRAN_NEEDED="package-meam" |
| 485 |
- |
| 486 |
-inherit eutils fortran-2 |
| 487 |
- |
| 488 |
-convert_month() { |
| 489 |
- case $1 in |
| 490 |
- 01) echo Jan |
| 491 |
- ;; |
| 492 |
- 02) echo Feb |
| 493 |
- ;; |
| 494 |
- 03) echo Mar |
| 495 |
- ;; |
| 496 |
- 04) echo Apr |
| 497 |
- ;; |
| 498 |
- 05) echo May |
| 499 |
- ;; |
| 500 |
- 06) echo Jun |
| 501 |
- ;; |
| 502 |
- 07) echo Jul |
| 503 |
- ;; |
| 504 |
- 08) echo Aug |
| 505 |
- ;; |
| 506 |
- 09) echo Sep |
| 507 |
- ;; |
| 508 |
- 10) echo Oct |
| 509 |
- ;; |
| 510 |
- 11) echo Nov |
| 511 |
- ;; |
| 512 |
- 12) echo Dec |
| 513 |
- ;; |
| 514 |
- *) echo unknown |
| 515 |
- ;; |
| 516 |
- esac |
| 517 |
-} |
| 518 |
- |
| 519 |
-MY_P=${PN}-$((10#${PV:6:2}))$(convert_month ${PV:4:2})${PV:2:2} |
| 520 |
- |
| 521 |
-DESCRIPTION="Large-scale Atomic/Molecular Massively Parallel Simulator" |
| 522 |
-HOMEPAGE="http://lammps.sandia.gov/" |
| 523 |
-SRC_URI="http://lammps.sandia.gov/tars/${MY_P}.tar.gz" |
| 524 |
- |
| 525 |
-LICENSE="GPL-2" |
| 526 |
-SLOT="0" |
| 527 |
-KEYWORDS="~amd64" |
| 528 |
-IUSE="doc examples gzip lammps-memalign mpi package-dipole package-meam package-rigid" |
| 529 |
- |
| 530 |
-DEPEND="mpi? ( virtual/mpi )" |
| 531 |
-RDEPEND="${DEPEND}" |
| 532 |
- |
| 533 |
-S="${WORKDIR}/${MY_P}" |
| 534 |
- |
| 535 |
-lmp_emake() { |
| 536 |
- local LAMMPS_INCLUDEFLAGS="$(usex gzip '-DLAMMPS_GZIP' '')" |
| 537 |
- LAMMPS_INCLUDEFLAGS+="$(usex lammps-memalign ' -DLAMMPS_MEMALIGN' '')" |
| 538 |
- |
| 539 |
- # Note: The lammps makefile uses CC to indicate the C++ compiler. |
| 540 |
- emake \ |
| 541 |
- ARCHIVE=$(tc-getAR) \ |
| 542 |
- CC=$(usex mpi "mpic++" "$(tc-getCXX)") \ |
| 543 |
- F90=$(usex mpi "mpif90" "$(tc-getFC)") \ |
| 544 |
- LINK=$(usex mpi "mpic++" "$(tc-getCXX)") \ |
| 545 |
- CCFLAGS="${CXXFLAGS}" \ |
| 546 |
- F90FLAGS="${FCFLAGS}" \ |
| 547 |
- LINKFLAGS="${LDFLAGS}" \ |
| 548 |
- LMP_INC="${LAMMPS_INCLUDEFLAGS}" \ |
| 549 |
- MPI_INC=$(usex mpi '' "-I../STUBS") \ |
| 550 |
- MPI_PATH=$(usex mpi '' '-L../STUBS') \ |
| 551 |
- MPI_LIB=$(usex mpi '' '-lmpi_stubs') \ |
| 552 |
- "$@" |
| 553 |
-} |
| 554 |
- |
| 555 |
-src_compile() { |
| 556 |
- # Compile stubs for serial version. |
| 557 |
- use mpi || lmp_emake -C src stubs |
| 558 |
- |
| 559 |
- # Build optional packages. |
| 560 |
- if use package-meam; then |
| 561 |
- lmp_emake -C src yes-meam |
| 562 |
- lmp_emake -j1 -C lib/meam -f Makefile.gfortran |
| 563 |
- fi |
| 564 |
- use package-dipole && emake -C src yes-dipole |
| 565 |
- use package-rigid && emake -C src yes-rigid |
| 566 |
- |
| 567 |
- # Compile. |
| 568 |
- lmp_emake -C src serial |
| 569 |
-} |
| 570 |
- |
| 571 |
-src_install() { |
| 572 |
- newbin "src/lmp_serial" "lmp" |
| 573 |
- |
| 574 |
- local LAMMPS_POTENTIALS="/usr/share/${PF}/potentials" |
| 575 |
- insinto "${LAMMPS_POTENTIALS}" |
| 576 |
- doins potentials/* |
| 577 |
- echo "LAMMPS_POTENTIALS=${LAMMPS_POTENTIALS}" > 99lammps |
| 578 |
- doenvd 99lammps |
| 579 |
- |
| 580 |
- if use examples; then |
| 581 |
- local LAMMPS_EXAMPLES="/usr/share/${PF}/examples" |
| 582 |
- insinto "${LAMMPS_EXAMPLES}" |
| 583 |
- doins -r examples/* |
| 584 |
- fi |
| 585 |
- |
| 586 |
- dodoc README |
| 587 |
- if use doc; then |
| 588 |
- dodoc doc/Manual.pdf |
| 589 |
- dohtml -r doc/* |
| 590 |
- fi |
| 591 |
-} |
| 592 |
|
| 593 |
diff --git a/sci-physics/lammps/lammps-20130930.ebuild b/sci-physics/lammps/lammps-20130930.ebuild |
| 594 |
deleted file mode 100644 |
| 595 |
index fe4c7ad..0000000 |
| 596 |
--- a/sci-physics/lammps/lammps-20130930.ebuild |
| 597 |
+++ /dev/null |
| 598 |
@@ -1,114 +0,0 @@ |
| 599 |
-# Copyright 1999-2013 Gentoo Foundation |
| 600 |
-# Distributed under the terms of the GNU General Public License v2 |
| 601 |
-# $Header: /var/cvsroot/gentoo-x86/sci-physics/lammps/lammps-20130526.ebuild,v 1.1 2013/06/26 23:53:11 ottxor Exp $ |
| 602 |
- |
| 603 |
-EAPI=5 |
| 604 |
- |
| 605 |
-FORTRAN_NEEDED="package-meam" |
| 606 |
- |
| 607 |
-inherit eutils fortran-2 |
| 608 |
- |
| 609 |
-convert_month() { |
| 610 |
- case $1 in |
| 611 |
- 01) echo Jan |
| 612 |
- ;; |
| 613 |
- 02) echo Feb |
| 614 |
- ;; |
| 615 |
- 03) echo Mar |
| 616 |
- ;; |
| 617 |
- 04) echo Apr |
| 618 |
- ;; |
| 619 |
- 05) echo May |
| 620 |
- ;; |
| 621 |
- 06) echo Jun |
| 622 |
- ;; |
| 623 |
- 07) echo Jul |
| 624 |
- ;; |
| 625 |
- 08) echo Aug |
| 626 |
- ;; |
| 627 |
- 09) echo Sep |
| 628 |
- ;; |
| 629 |
- 10) echo Oct |
| 630 |
- ;; |
| 631 |
- 11) echo Nov |
| 632 |
- ;; |
| 633 |
- 12) echo Dec |
| 634 |
- ;; |
| 635 |
- *) echo unknown |
| 636 |
- ;; |
| 637 |
- esac |
| 638 |
-} |
| 639 |
- |
| 640 |
-MY_P=${PN}-$((10#${PV:6:2}))$(convert_month ${PV:4:2})${PV:2:2} |
| 641 |
- |
| 642 |
-DESCRIPTION="Large-scale Atomic/Molecular Massively Parallel Simulator" |
| 643 |
-HOMEPAGE="http://lammps.sandia.gov/" |
| 644 |
-SRC_URI="http://lammps.sandia.gov/tars/${MY_P}.tar.gz" |
| 645 |
- |
| 646 |
-LICENSE="GPL-2" |
| 647 |
-SLOT="0" |
| 648 |
-KEYWORDS="~amd64" |
| 649 |
-IUSE="doc examples gzip lammps-memalign mpi package-dipole package-meam package-rigid" |
| 650 |
- |
| 651 |
-DEPEND="mpi? ( virtual/mpi )" |
| 652 |
-RDEPEND="${DEPEND}" |
| 653 |
- |
| 654 |
-S="${WORKDIR}/${MY_P}" |
| 655 |
- |
| 656 |
-lmp_emake() { |
| 657 |
- local LAMMPS_INCLUDEFLAGS="$(usex gzip '-DLAMMPS_GZIP' '')" |
| 658 |
- LAMMPS_INCLUDEFLAGS+="$(usex lammps-memalign ' -DLAMMPS_MEMALIGN' '')" |
| 659 |
- |
| 660 |
- # Note: The lammps makefile uses CC to indicate the C++ compiler. |
| 661 |
- emake \ |
| 662 |
- ARCHIVE=$(tc-getAR) \ |
| 663 |
- CC=$(usex mpi "mpic++" "$(tc-getCXX)") \ |
| 664 |
- F90=$(usex mpi "mpif90" "$(tc-getFC)") \ |
| 665 |
- LINK=$(usex mpi "mpic++" "$(tc-getCXX)") \ |
| 666 |
- CCFLAGS="${CXXFLAGS}" \ |
| 667 |
- F90FLAGS="${FCFLAGS}" \ |
| 668 |
- LINKFLAGS="${LDFLAGS}" \ |
| 669 |
- LMP_INC="${LAMMPS_INCLUDEFLAGS}" \ |
| 670 |
- MPI_INC=$(usex mpi '' "-I../STUBS") \ |
| 671 |
- MPI_PATH=$(usex mpi '' '-L../STUBS') \ |
| 672 |
- MPI_LIB=$(usex mpi '' '-lmpi_stubs') \ |
| 673 |
- "$@" |
| 674 |
-} |
| 675 |
- |
| 676 |
-src_compile() { |
| 677 |
- # Compile stubs for serial version. |
| 678 |
- use mpi || lmp_emake -C src stubs |
| 679 |
- |
| 680 |
- # Build optional packages. |
| 681 |
- if use package-meam; then |
| 682 |
- lmp_emake -C src yes-meam |
| 683 |
- lmp_emake -j1 -C lib/meam -f Makefile.gfortran |
| 684 |
- fi |
| 685 |
- use package-dipole && emake -C src yes-dipole |
| 686 |
- use package-rigid && emake -C src yes-rigid |
| 687 |
- |
| 688 |
- # Compile. |
| 689 |
- lmp_emake -C src serial |
| 690 |
-} |
| 691 |
- |
| 692 |
-src_install() { |
| 693 |
- newbin "src/lmp_serial" "lmp" |
| 694 |
- |
| 695 |
- local LAMMPS_POTENTIALS="/usr/share/${PF}/potentials" |
| 696 |
- insinto "${LAMMPS_POTENTIALS}" |
| 697 |
- doins potentials/* |
| 698 |
- echo "LAMMPS_POTENTIALS=${LAMMPS_POTENTIALS}" > 99lammps |
| 699 |
- doenvd 99lammps |
| 700 |
- |
| 701 |
- if use examples; then |
| 702 |
- local LAMMPS_EXAMPLES="/usr/share/${PF}/examples" |
| 703 |
- insinto "${LAMMPS_EXAMPLES}" |
| 704 |
- doins -r examples/* |
| 705 |
- fi |
| 706 |
- |
| 707 |
- dodoc README |
| 708 |
- if use doc; then |
| 709 |
- dodoc doc/Manual.pdf |
| 710 |
- dohtml -r doc/* |
| 711 |
- fi |
| 712 |
-} |
| 713 |
|
| 714 |
diff --git a/sci-physics/lammps/lammps-20131111.ebuild b/sci-physics/lammps/lammps-20131111.ebuild |
| 715 |
deleted file mode 100644 |
| 716 |
index fe4c7ad..0000000 |
| 717 |
--- a/sci-physics/lammps/lammps-20131111.ebuild |
| 718 |
+++ /dev/null |
| 719 |
@@ -1,114 +0,0 @@ |
| 720 |
-# Copyright 1999-2013 Gentoo Foundation |
| 721 |
-# Distributed under the terms of the GNU General Public License v2 |
| 722 |
-# $Header: /var/cvsroot/gentoo-x86/sci-physics/lammps/lammps-20130526.ebuild,v 1.1 2013/06/26 23:53:11 ottxor Exp $ |
| 723 |
- |
| 724 |
-EAPI=5 |
| 725 |
- |
| 726 |
-FORTRAN_NEEDED="package-meam" |
| 727 |
- |
| 728 |
-inherit eutils fortran-2 |
| 729 |
- |
| 730 |
-convert_month() { |
| 731 |
- case $1 in |
| 732 |
- 01) echo Jan |
| 733 |
- ;; |
| 734 |
- 02) echo Feb |
| 735 |
- ;; |
| 736 |
- 03) echo Mar |
| 737 |
- ;; |
| 738 |
- 04) echo Apr |
| 739 |
- ;; |
| 740 |
- 05) echo May |
| 741 |
- ;; |
| 742 |
- 06) echo Jun |
| 743 |
- ;; |
| 744 |
- 07) echo Jul |
| 745 |
- ;; |
| 746 |
- 08) echo Aug |
| 747 |
- ;; |
| 748 |
- 09) echo Sep |
| 749 |
- ;; |
| 750 |
- 10) echo Oct |
| 751 |
- ;; |
| 752 |
- 11) echo Nov |
| 753 |
- ;; |
| 754 |
- 12) echo Dec |
| 755 |
- ;; |
| 756 |
- *) echo unknown |
| 757 |
- ;; |
| 758 |
- esac |
| 759 |
-} |
| 760 |
- |
| 761 |
-MY_P=${PN}-$((10#${PV:6:2}))$(convert_month ${PV:4:2})${PV:2:2} |
| 762 |
- |
| 763 |
-DESCRIPTION="Large-scale Atomic/Molecular Massively Parallel Simulator" |
| 764 |
-HOMEPAGE="http://lammps.sandia.gov/" |
| 765 |
-SRC_URI="http://lammps.sandia.gov/tars/${MY_P}.tar.gz" |
| 766 |
- |
| 767 |
-LICENSE="GPL-2" |
| 768 |
-SLOT="0" |
| 769 |
-KEYWORDS="~amd64" |
| 770 |
-IUSE="doc examples gzip lammps-memalign mpi package-dipole package-meam package-rigid" |
| 771 |
- |
| 772 |
-DEPEND="mpi? ( virtual/mpi )" |
| 773 |
-RDEPEND="${DEPEND}" |
| 774 |
- |
| 775 |
-S="${WORKDIR}/${MY_P}" |
| 776 |
- |
| 777 |
-lmp_emake() { |
| 778 |
- local LAMMPS_INCLUDEFLAGS="$(usex gzip '-DLAMMPS_GZIP' '')" |
| 779 |
- LAMMPS_INCLUDEFLAGS+="$(usex lammps-memalign ' -DLAMMPS_MEMALIGN' '')" |
| 780 |
- |
| 781 |
- # Note: The lammps makefile uses CC to indicate the C++ compiler. |
| 782 |
- emake \ |
| 783 |
- ARCHIVE=$(tc-getAR) \ |
| 784 |
- CC=$(usex mpi "mpic++" "$(tc-getCXX)") \ |
| 785 |
- F90=$(usex mpi "mpif90" "$(tc-getFC)") \ |
| 786 |
- LINK=$(usex mpi "mpic++" "$(tc-getCXX)") \ |
| 787 |
- CCFLAGS="${CXXFLAGS}" \ |
| 788 |
- F90FLAGS="${FCFLAGS}" \ |
| 789 |
- LINKFLAGS="${LDFLAGS}" \ |
| 790 |
- LMP_INC="${LAMMPS_INCLUDEFLAGS}" \ |
| 791 |
- MPI_INC=$(usex mpi '' "-I../STUBS") \ |
| 792 |
- MPI_PATH=$(usex mpi '' '-L../STUBS') \ |
| 793 |
- MPI_LIB=$(usex mpi '' '-lmpi_stubs') \ |
| 794 |
- "$@" |
| 795 |
-} |
| 796 |
- |
| 797 |
-src_compile() { |
| 798 |
- # Compile stubs for serial version. |
| 799 |
- use mpi || lmp_emake -C src stubs |
| 800 |
- |
| 801 |
- # Build optional packages. |
| 802 |
- if use package-meam; then |
| 803 |
- lmp_emake -C src yes-meam |
| 804 |
- lmp_emake -j1 -C lib/meam -f Makefile.gfortran |
| 805 |
- fi |
| 806 |
- use package-dipole && emake -C src yes-dipole |
| 807 |
- use package-rigid && emake -C src yes-rigid |
| 808 |
- |
| 809 |
- # Compile. |
| 810 |
- lmp_emake -C src serial |
| 811 |
-} |
| 812 |
- |
| 813 |
-src_install() { |
| 814 |
- newbin "src/lmp_serial" "lmp" |
| 815 |
- |
| 816 |
- local LAMMPS_POTENTIALS="/usr/share/${PF}/potentials" |
| 817 |
- insinto "${LAMMPS_POTENTIALS}" |
| 818 |
- doins potentials/* |
| 819 |
- echo "LAMMPS_POTENTIALS=${LAMMPS_POTENTIALS}" > 99lammps |
| 820 |
- doenvd 99lammps |
| 821 |
- |
| 822 |
- if use examples; then |
| 823 |
- local LAMMPS_EXAMPLES="/usr/share/${PF}/examples" |
| 824 |
- insinto "${LAMMPS_EXAMPLES}" |
| 825 |
- doins -r examples/* |
| 826 |
- fi |
| 827 |
- |
| 828 |
- dodoc README |
| 829 |
- if use doc; then |
| 830 |
- dodoc doc/Manual.pdf |
| 831 |
- dohtml -r doc/* |
| 832 |
- fi |
| 833 |
-} |
| 834 |
|
| 835 |
diff --git a/sci-physics/lammps/lammps-20131123.ebuild b/sci-physics/lammps/lammps-20131123.ebuild |
| 836 |
deleted file mode 100644 |
| 837 |
index fe4c7ad..0000000 |
| 838 |
--- a/sci-physics/lammps/lammps-20131123.ebuild |
| 839 |
+++ /dev/null |
| 840 |
@@ -1,114 +0,0 @@ |
| 841 |
-# Copyright 1999-2013 Gentoo Foundation |
| 842 |
-# Distributed under the terms of the GNU General Public License v2 |
| 843 |
-# $Header: /var/cvsroot/gentoo-x86/sci-physics/lammps/lammps-20130526.ebuild,v 1.1 2013/06/26 23:53:11 ottxor Exp $ |
| 844 |
- |
| 845 |
-EAPI=5 |
| 846 |
- |
| 847 |
-FORTRAN_NEEDED="package-meam" |
| 848 |
- |
| 849 |
-inherit eutils fortran-2 |
| 850 |
- |
| 851 |
-convert_month() { |
| 852 |
- case $1 in |
| 853 |
- 01) echo Jan |
| 854 |
- ;; |
| 855 |
- 02) echo Feb |
| 856 |
- ;; |
| 857 |
- 03) echo Mar |
| 858 |
- ;; |
| 859 |
- 04) echo Apr |
| 860 |
- ;; |
| 861 |
- 05) echo May |
| 862 |
- ;; |
| 863 |
- 06) echo Jun |
| 864 |
- ;; |
| 865 |
- 07) echo Jul |
| 866 |
- ;; |
| 867 |
- 08) echo Aug |
| 868 |
- ;; |
| 869 |
- 09) echo Sep |
| 870 |
- ;; |
| 871 |
- 10) echo Oct |
| 872 |
- ;; |
| 873 |
- 11) echo Nov |
| 874 |
- ;; |
| 875 |
- 12) echo Dec |
| 876 |
- ;; |
| 877 |
- *) echo unknown |
| 878 |
- ;; |
| 879 |
- esac |
| 880 |
-} |
| 881 |
- |
| 882 |
-MY_P=${PN}-$((10#${PV:6:2}))$(convert_month ${PV:4:2})${PV:2:2} |
| 883 |
- |
| 884 |
-DESCRIPTION="Large-scale Atomic/Molecular Massively Parallel Simulator" |
| 885 |
-HOMEPAGE="http://lammps.sandia.gov/" |
| 886 |
-SRC_URI="http://lammps.sandia.gov/tars/${MY_P}.tar.gz" |
| 887 |
- |
| 888 |
-LICENSE="GPL-2" |
| 889 |
-SLOT="0" |
| 890 |
-KEYWORDS="~amd64" |
| 891 |
-IUSE="doc examples gzip lammps-memalign mpi package-dipole package-meam package-rigid" |
| 892 |
- |
| 893 |
-DEPEND="mpi? ( virtual/mpi )" |
| 894 |
-RDEPEND="${DEPEND}" |
| 895 |
- |
| 896 |
-S="${WORKDIR}/${MY_P}" |
| 897 |
- |
| 898 |
-lmp_emake() { |
| 899 |
- local LAMMPS_INCLUDEFLAGS="$(usex gzip '-DLAMMPS_GZIP' '')" |
| 900 |
- LAMMPS_INCLUDEFLAGS+="$(usex lammps-memalign ' -DLAMMPS_MEMALIGN' '')" |
| 901 |
- |
| 902 |
- # Note: The lammps makefile uses CC to indicate the C++ compiler. |
| 903 |
- emake \ |
| 904 |
- ARCHIVE=$(tc-getAR) \ |
| 905 |
- CC=$(usex mpi "mpic++" "$(tc-getCXX)") \ |
| 906 |
- F90=$(usex mpi "mpif90" "$(tc-getFC)") \ |
| 907 |
- LINK=$(usex mpi "mpic++" "$(tc-getCXX)") \ |
| 908 |
- CCFLAGS="${CXXFLAGS}" \ |
| 909 |
- F90FLAGS="${FCFLAGS}" \ |
| 910 |
- LINKFLAGS="${LDFLAGS}" \ |
| 911 |
- LMP_INC="${LAMMPS_INCLUDEFLAGS}" \ |
| 912 |
- MPI_INC=$(usex mpi '' "-I../STUBS") \ |
| 913 |
- MPI_PATH=$(usex mpi '' '-L../STUBS') \ |
| 914 |
- MPI_LIB=$(usex mpi '' '-lmpi_stubs') \ |
| 915 |
- "$@" |
| 916 |
-} |
| 917 |
- |
| 918 |
-src_compile() { |
| 919 |
- # Compile stubs for serial version. |
| 920 |
- use mpi || lmp_emake -C src stubs |
| 921 |
- |
| 922 |
- # Build optional packages. |
| 923 |
- if use package-meam; then |
| 924 |
- lmp_emake -C src yes-meam |
| 925 |
- lmp_emake -j1 -C lib/meam -f Makefile.gfortran |
| 926 |
- fi |
| 927 |
- use package-dipole && emake -C src yes-dipole |
| 928 |
- use package-rigid && emake -C src yes-rigid |
| 929 |
- |
| 930 |
- # Compile. |
| 931 |
- lmp_emake -C src serial |
| 932 |
-} |
| 933 |
- |
| 934 |
-src_install() { |
| 935 |
- newbin "src/lmp_serial" "lmp" |
| 936 |
- |
| 937 |
- local LAMMPS_POTENTIALS="/usr/share/${PF}/potentials" |
| 938 |
- insinto "${LAMMPS_POTENTIALS}" |
| 939 |
- doins potentials/* |
| 940 |
- echo "LAMMPS_POTENTIALS=${LAMMPS_POTENTIALS}" > 99lammps |
| 941 |
- doenvd 99lammps |
| 942 |
- |
| 943 |
- if use examples; then |
| 944 |
- local LAMMPS_EXAMPLES="/usr/share/${PF}/examples" |
| 945 |
- insinto "${LAMMPS_EXAMPLES}" |
| 946 |
- doins -r examples/* |
| 947 |
- fi |
| 948 |
- |
| 949 |
- dodoc README |
| 950 |
- if use doc; then |
| 951 |
- dodoc doc/Manual.pdf |
| 952 |
- dohtml -r doc/* |
| 953 |
- fi |
| 954 |
-} |
| 955 |
|
| 956 |
diff --git a/sci-physics/lammps/lammps-20131201.ebuild b/sci-physics/lammps/lammps-20131201.ebuild |
| 957 |
deleted file mode 100644 |
| 958 |
index fe4c7ad..0000000 |
| 959 |
--- a/sci-physics/lammps/lammps-20131201.ebuild |
| 960 |
+++ /dev/null |
| 961 |
@@ -1,114 +0,0 @@ |
| 962 |
-# Copyright 1999-2013 Gentoo Foundation |
| 963 |
-# Distributed under the terms of the GNU General Public License v2 |
| 964 |
-# $Header: /var/cvsroot/gentoo-x86/sci-physics/lammps/lammps-20130526.ebuild,v 1.1 2013/06/26 23:53:11 ottxor Exp $ |
| 965 |
- |
| 966 |
-EAPI=5 |
| 967 |
- |
| 968 |
-FORTRAN_NEEDED="package-meam" |
| 969 |
- |
| 970 |
-inherit eutils fortran-2 |
| 971 |
- |
| 972 |
-convert_month() { |
| 973 |
- case $1 in |
| 974 |
- 01) echo Jan |
| 975 |
- ;; |
| 976 |
- 02) echo Feb |
| 977 |
- ;; |
| 978 |
- 03) echo Mar |
| 979 |
- ;; |
| 980 |
- 04) echo Apr |
| 981 |
- ;; |
| 982 |
- 05) echo May |
| 983 |
- ;; |
| 984 |
- 06) echo Jun |
| 985 |
- ;; |
| 986 |
- 07) echo Jul |
| 987 |
- ;; |
| 988 |
- 08) echo Aug |
| 989 |
- ;; |
| 990 |
- 09) echo Sep |
| 991 |
- ;; |
| 992 |
- 10) echo Oct |
| 993 |
- ;; |
| 994 |
- 11) echo Nov |
| 995 |
- ;; |
| 996 |
- 12) echo Dec |
| 997 |
- ;; |
| 998 |
- *) echo unknown |
| 999 |
- ;; |
| 1000 |
- esac |
| 1001 |
-} |
| 1002 |
- |
| 1003 |
-MY_P=${PN}-$((10#${PV:6:2}))$(convert_month ${PV:4:2})${PV:2:2} |
| 1004 |
- |
| 1005 |
-DESCRIPTION="Large-scale Atomic/Molecular Massively Parallel Simulator" |
| 1006 |
-HOMEPAGE="http://lammps.sandia.gov/" |
| 1007 |
-SRC_URI="http://lammps.sandia.gov/tars/${MY_P}.tar.gz" |
| 1008 |
- |
| 1009 |
-LICENSE="GPL-2" |
| 1010 |
-SLOT="0" |
| 1011 |
-KEYWORDS="~amd64" |
| 1012 |
-IUSE="doc examples gzip lammps-memalign mpi package-dipole package-meam package-rigid" |
| 1013 |
- |
| 1014 |
-DEPEND="mpi? ( virtual/mpi )" |
| 1015 |
-RDEPEND="${DEPEND}" |
| 1016 |
- |
| 1017 |
-S="${WORKDIR}/${MY_P}" |
| 1018 |
- |
| 1019 |
-lmp_emake() { |
| 1020 |
- local LAMMPS_INCLUDEFLAGS="$(usex gzip '-DLAMMPS_GZIP' '')" |
| 1021 |
- LAMMPS_INCLUDEFLAGS+="$(usex lammps-memalign ' -DLAMMPS_MEMALIGN' '')" |
| 1022 |
- |
| 1023 |
- # Note: The lammps makefile uses CC to indicate the C++ compiler. |
| 1024 |
- emake \ |
| 1025 |
- ARCHIVE=$(tc-getAR) \ |
| 1026 |
- CC=$(usex mpi "mpic++" "$(tc-getCXX)") \ |
| 1027 |
- F90=$(usex mpi "mpif90" "$(tc-getFC)") \ |
| 1028 |
- LINK=$(usex mpi "mpic++" "$(tc-getCXX)") \ |
| 1029 |
- CCFLAGS="${CXXFLAGS}" \ |
| 1030 |
- F90FLAGS="${FCFLAGS}" \ |
| 1031 |
- LINKFLAGS="${LDFLAGS}" \ |
| 1032 |
- LMP_INC="${LAMMPS_INCLUDEFLAGS}" \ |
| 1033 |
- MPI_INC=$(usex mpi '' "-I../STUBS") \ |
| 1034 |
- MPI_PATH=$(usex mpi '' '-L../STUBS') \ |
| 1035 |
- MPI_LIB=$(usex mpi '' '-lmpi_stubs') \ |
| 1036 |
- "$@" |
| 1037 |
-} |
| 1038 |
- |
| 1039 |
-src_compile() { |
| 1040 |
- # Compile stubs for serial version. |
| 1041 |
- use mpi || lmp_emake -C src stubs |
| 1042 |
- |
| 1043 |
- # Build optional packages. |
| 1044 |
- if use package-meam; then |
| 1045 |
- lmp_emake -C src yes-meam |
| 1046 |
- lmp_emake -j1 -C lib/meam -f Makefile.gfortran |
| 1047 |
- fi |
| 1048 |
- use package-dipole && emake -C src yes-dipole |
| 1049 |
- use package-rigid && emake -C src yes-rigid |
| 1050 |
- |
| 1051 |
- # Compile. |
| 1052 |
- lmp_emake -C src serial |
| 1053 |
-} |
| 1054 |
- |
| 1055 |
-src_install() { |
| 1056 |
- newbin "src/lmp_serial" "lmp" |
| 1057 |
- |
| 1058 |
- local LAMMPS_POTENTIALS="/usr/share/${PF}/potentials" |
| 1059 |
- insinto "${LAMMPS_POTENTIALS}" |
| 1060 |
- doins potentials/* |
| 1061 |
- echo "LAMMPS_POTENTIALS=${LAMMPS_POTENTIALS}" > 99lammps |
| 1062 |
- doenvd 99lammps |
| 1063 |
- |
| 1064 |
- if use examples; then |
| 1065 |
- local LAMMPS_EXAMPLES="/usr/share/${PF}/examples" |
| 1066 |
- insinto "${LAMMPS_EXAMPLES}" |
| 1067 |
- doins -r examples/* |
| 1068 |
- fi |
| 1069 |
- |
| 1070 |
- dodoc README |
| 1071 |
- if use doc; then |
| 1072 |
- dodoc doc/Manual.pdf |
| 1073 |
- dohtml -r doc/* |
| 1074 |
- fi |
| 1075 |
-} |
| 1076 |
|
| 1077 |
diff --git a/sci-physics/lammps/metadata.xml b/sci-physics/lammps/metadata.xml |
| 1078 |
deleted file mode 100644 |
| 1079 |
index 7a1dc94..0000000 |
| 1080 |
--- a/sci-physics/lammps/metadata.xml |
| 1081 |
+++ /dev/null |
| 1082 |
@@ -1,31 +0,0 @@ |
| 1083 |
-<?xml version="1.0" encoding="UTF-8"?> |
| 1084 |
-<!DOCTYPE pkgmetadata SYSTEM "http://www.gentoo.org/dtd/metadata.dtd"> |
| 1085 |
-<pkgmetadata> |
| 1086 |
- <longdescription lang="en"> |
| 1087 |
- LAMMPS is a classical molecular dynamics code, and an acronym for |
| 1088 |
- Large-scale Atomic/Molecular Massively Parallel Simulator. |
| 1089 |
- |
| 1090 |
- LAMMPS has potentials for soft materials (biomolecules, polymers) and |
| 1091 |
- solid-state materials (metals, semiconductors) and coarse-grained or |
| 1092 |
- mesoscopic systems. It can be used to model atoms or, more generically, |
| 1093 |
- as a parallel particle simulator at the atomic, meso, or continuum |
| 1094 |
- scale. |
| 1095 |
- |
| 1096 |
- LAMMPS runs on single processors or in parallel using message-passing |
| 1097 |
- techniques and a spatial-decomposition of the simulation domain. The |
| 1098 |
- code is designed to be easy to modify or extend with new functionality. |
| 1099 |
- </longdescription> |
| 1100 |
- <use> |
| 1101 |
- <flag name="lammps-memalign">Enables the use of the posix_memalign() |
| 1102 |
- call instead of malloc() when large chunks or memory are allocated |
| 1103 |
- by LAMMPS</flag> |
| 1104 |
- <flag name="package-meam">modified EAM potential</flag> |
| 1105 |
- <flag name="package-dipole">point dipole particles</flag> |
| 1106 |
- <flag name="package-rigid">rigid bodies</flag> |
| 1107 |
- </use> |
| 1108 |
- <herd>sci-physics</herd> |
| 1109 |
- <maintainer> |
| 1110 |
- <email>nicolasbock@g.o</email> |
| 1111 |
- </maintainer> |
| 1112 |
-</pkgmetadata> |
| 1113 |
- |
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