nicolasbock    15/02/17 16:53:27

  Modified:             ChangeLog
  Added:                lammps-20150210.ebuild
  Log:
  sci-physics/lammps: Adding new version.
  
  (Portage version: 2.2.14/cvs/Linux x86_64, signed Manifest commit with key 
AC91CA52)

Revision  Changes    Path
1.69                 sci-physics/lammps/ChangeLog

file : 
http://sources.gentoo.org/viewvc.cgi/gentoo-x86/sci-physics/lammps/ChangeLog?rev=1.69&view=markup
plain: 
http://sources.gentoo.org/viewvc.cgi/gentoo-x86/sci-physics/lammps/ChangeLog?rev=1.69&content-type=text/plain
diff : 
http://sources.gentoo.org/viewvc.cgi/gentoo-x86/sci-physics/lammps/ChangeLog?r1=1.68&r2=1.69

Index: ChangeLog
===================================================================
RCS file: /var/cvsroot/gentoo-x86/sci-physics/lammps/ChangeLog,v
retrieving revision 1.68
retrieving revision 1.69
diff -u -r1.68 -r1.69
--- ChangeLog   8 Feb 2015 13:46:11 -0000       1.68
+++ ChangeLog   17 Feb 2015 16:53:27 -0000      1.69
@@ -1,6 +1,11 @@
 # ChangeLog for sci-physics/lammps
 # Copyright 1999-2015 Gentoo Foundation; Distributed under the GPL v2
-# $Header: /var/cvsroot/gentoo-x86/sci-physics/lammps/ChangeLog,v 1.68 
2015/02/08 13:46:11 nicolasbock Exp $
+# $Header: /var/cvsroot/gentoo-x86/sci-physics/lammps/ChangeLog,v 1.69 
2015/02/17 16:53:27 nicolasbock Exp $
+
+*lammps-20150210 (17 Feb 2015)
+
+  17 Feb 2015; Nicolas Bock <nicolasb...@gentoo.org> +lammps-20150210.ebuild:
+  sci-physics/lammps: Adding new version.
 
 *lammps-20150206 (08 Feb 2015)
 



1.1                  sci-physics/lammps/lammps-20150210.ebuild

file : 
http://sources.gentoo.org/viewvc.cgi/gentoo-x86/sci-physics/lammps/lammps-20150210.ebuild?rev=1.1&view=markup
plain: 
http://sources.gentoo.org/viewvc.cgi/gentoo-x86/sci-physics/lammps/lammps-20150210.ebuild?rev=1.1&content-type=text/plain

Index: lammps-20150210.ebuild
===================================================================
# Copyright 1999-2015 Gentoo Foundation
# Distributed under the terms of the GNU General Public License v2
# $Header: /var/cvsroot/gentoo-x86/sci-physics/lammps/lammps-20150210.ebuild,v 
1.1 2015/02/17 16:53:27 nicolasbock Exp $

EAPI=5

inherit eutils flag-o-matic fortran-2 multilib

convert_month() {
        case $1 in
                01) echo Jan
                        ;;
                02) echo Feb
                        ;;
                03) echo Mar
                        ;;
                04) echo Apr
                        ;;
                05) echo May
                        ;;
                06) echo Jun
                        ;;
                07) echo Jul
                        ;;
                08) echo Aug
                        ;;
                09) echo Sep
                        ;;
                10) echo Oct
                        ;;
                11) echo Nov
                        ;;
                12) echo Dec
                        ;;
                *)  echo unknown
                        ;;
        esac
}

MY_P=${PN}-$((10#${PV:6:2}))$(convert_month ${PV:4:2})${PV:2:2}

DESCRIPTION="Large-scale Atomic/Molecular Massively Parallel Simulator"
HOMEPAGE="http://lammps.sandia.gov/";
SRC_URI="http://lammps.sandia.gov/tars/${MY_P}.tar.gz";

LICENSE="GPL-2"
SLOT="0"
KEYWORDS="~amd64 ~x86"
IUSE="doc examples gzip lammps-memalign mpi static-libs"

DEPEND="
        mpi? (
                virtual/blas
                virtual/lapack
                virtual/mpi
        )
        sci-libs/voro++
        "
RDEPEND="${DEPEND}"

S="${WORKDIR}/${MY_P}"

lmp_emake() {
        local LAMMPS_INCLUDEFLAGS
        LAMMPS_INCLUDEFLAGS="$(usex gzip '-DLAMMPS_GZIP' '')"
        LAMMPS_INCLUDEFLAGS+="$(usex lammps-memalign ' -DLAMMPS_MEMALIGN' '')"

        # The lammps makefile uses CC to indicate the C++ compiler.
        emake \
                ARCHIVE=$(tc-getAR) \
                CC=$(usex mpi "mpic++" "$(tc-getCXX)") \
                F90=$(usex mpi "mpif90" "$(tc-getFC)") \
                LINK=$(usex mpi "mpic++" "$(tc-getCXX)") \
                CCFLAGS="${CXXFLAGS}" \
                F90FLAGS="${FCFLAGS}" \
                LINKFLAGS="${LDFLAGS}" \
                LMP_INC="${LAMMPS_INCLUDEFLAGS}" \
                MPI_INC=$(usex mpi '' "-I../STUBS") \
                MPI_PATH=$(usex mpi '' '-L../STUBS') \
                MPI_LIB=$(usex mpi '' '-lmpi_stubs') \
                user-atc_SYSLIB="$(usex mpi "$($(tc-getPKG_CONFIG) --libs blas) 
$($(tc-getPKG_CONFIG) --libs lapack)" '')"\
                "$@"
}

src_prepare() {
        # Fix inconsistent use of SHFLAGS.
        sed -i \
                -e 's:voronoi_SYSINC\s\+=.*$:voronoi_SYSINC = 
-I/usr/include/voro++:' \
                -e 's:voronoi_SYSPATH\s\+=.*$:voronoi_SYSPATH =:' \
                lib/voronoi/Makefile.lammps || die

        # Fix missing .so name.
        sed -i \
                -e 's:SHLIBFLAGS\s\+=\s\+:SHLIBFLAGS = 
-Wl,-soname,liblammps.so.0 :' \
                src/MAKE/Makefile.serial || die

        # Fix makefile in tools.
        sed -i \
                -e 's:g++:$(CXX) $(CXXFLAGS):' \
                -e 's:gcc:$(CC) $(CCFLAGS):' \
                -e 's:ifort:$(FC) $(FCFLAGS):' \
                tools/Makefile || die
}

src_compile() {
        # Prepare compiler flags.
        append-cxxflags -fPIC -I../../src
        append-fflags -fPIC

        # Compile stubs for serial version.
        use mpi || lmp_emake -C src stubs

        # Build packages
        emake -C src yes-asphere
        emake -C src yes-body
        emake -C src yes-class2
        emake -C src yes-colloid
        emake -C src yes-dipole
        emake -C src yes-fld
        #emake -C src yes-gpu
        emake -C src yes-granular
        # Need OpenKIM external dependency.
        #emake -C src yes-kim
        # Need Kokkos external dependency.
        #emake -C src yes-kokkos
        emake -C src yes-kspace
        emake -C src yes-manybody
        emake -C src yes-mc
        lmp_emake -C src yes-meam
        lmp_emake -j1 -C lib/meam -f Makefile.gfortran
        emake -C src yes-misc
        emake -C src yes-molecule
        #emake -C src yes-mpiio
        emake -C src yes-opt
        emake -C src yes-peri
        emake -C src yes-poems
        lmp_emake -C lib/poems -f Makefile.g++
        emake -C src yes-reax
        lmp_emake -j1 -C lib/reax -f Makefile.gfortran
        emake -C src yes-replica
        emake -C src yes-rigid
        emake -C src yes-shock
        emake -C src yes-snap
        emake -C src yes-srd
        emake -C src yes-voronoi
        emake -C src yes-xtc

        emake -C src yes-user-eff
        emake -C src yes-user-fep
        use mpi && emake -C src yes-user-lb
        emake -C src yes-user-phonon
        emake -C src yes-user-sph

        if use mpi; then
                emake -C src yes-user-atc
                lmp_emake -C lib/atc -f Makefile.g++
        fi

        if use static-libs; then
                # Build static library.
                lmp_emake -C src makelib
                lmp_emake -C src -f Makefile.lib serial
        fi

        # Build shared library.
        lmp_emake -C src makeshlib
        lmp_emake -C src -f Makefile.shlib serial

        # Compile main executable.
        lmp_emake -C src serial

        # Compile tools.
        emake -C tools binary2txt chain micelle2d data2xmovie
}

src_install() {
        use static-libs && newlib.a src/liblammps_serial.a liblammps.a
        newlib.so src/liblammps_serial.so liblammps.so.0.0.0
        dosym liblammps.so.0.0.0 /usr/$(get_libdir)/liblammps.so
        dosym liblammps.so.0.0.0 /usr/$(get_libdir)/liblammps.so.0
        newbin src/lmp_serial lmp
        dobin tools/binary2txt
        # Don't forget to add header files of optional packages as they are 
added
        # to this ebuild. There may also be .mod files from Fortran based
        # packages.
        insinto "/usr/include/${PN}"
        doins -r src/*.h lib/meam/*.mod

        local LAMMPS_POTENTIALS="usr/share/${PN}/potentials"
        insinto "/${LAMMPS_POTENTIALS}"
        doins potentials/*
        echo "LAMMPS_POTENTIALS=${EROOT}${LAMMPS_POTENTIALS}" > 99lammps
        doenvd 99lammps

        if use examples; then
                local LAMMPS_EXAMPLES="/usr/share/${PN}/examples"
                insinto "${LAMMPS_EXAMPLES}"
                doins -r examples/*
        fi

        dodoc README
        if use doc; then
                dodoc doc/Manual.pdf
                dohtml -r doc/*
        fi
}




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