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authorYuri Victorovich <yuri@FreeBSD.org>2020-05-04 19:58:02 +0000
committerYuri Victorovich <yuri@FreeBSD.org>2020-05-04 19:58:02 +0000
commit3464833804a75b9242f7eff398b63aa592defc44 (patch)
tree0bed78e5f478107b17c64781dd811a46ed4664ec /science/lammps
parent4ac774e12da1d0a1ed760f62fd94754931ec4e42 (diff)
downloadports-3464833804a75b9242f7eff398b63aa592defc44.tar.gz
ports-3464833804a75b9242f7eff398b63aa592defc44.zip
science/lammps: Add the PLUMED option
Also: * Change USER-LB to be available only for MPI=on * Sort options alphabetically
Notes
Notes: svn path=/head/; revision=533982
Diffstat (limited to 'science/lammps')
-rw-r--r--science/lammps/Makefile37
1 files changed, 21 insertions, 16 deletions
diff --git a/science/lammps/Makefile b/science/lammps/Makefile
index 85d7b8e74eca..e533605d54db 100644
--- a/science/lammps/Makefile
+++ b/science/lammps/Makefile
@@ -2,7 +2,7 @@
PORTNAME= lammps
PORTVERSION= ${GH_TAGNAME:C/(stable|patch)_([0-9]{1,2})([A-Z][a-z][a-z])([0-9]{4})/\4.\3.\2/S/Jan/01/S/Feb/02/S/Mar/03/S/Apr/04/S/May/05/S/Jun/06/S/Jul/07/S/Aug/08/S/Sep/09/S/Oct/10/S/Nov/11/S/Dec/12/}
-PORTREVISION= 8
+PORTREVISION= 9
CATEGORIES= science
PATCH_SITES= https://github.com/${GH_ACCOUNT}/${GH_PROJECT}/commit/
@@ -41,26 +41,27 @@ CMAKE_ON+= PKG_ASPHERE PKG_BODY PKG_CLASS2 PKG_COLLOID PKG_COMPRESS PKG_DIPOLE
CMAKE_ON+= PKG_GRANULAR PKG_KSPACE PKG_MANYBODY PKG_MC PKG_MESSAGE PKG_MISC PKG_MOLECULE PKG_PERI PKG_POEMS PKG_QEQ
CMAKE_ON+= PKG_REPLICA PKG_RIGID PKG_SHOCK PKG_SPIN PKG_SNAP PKG_SRD
CMAKE_ON+= PKG_USER-ATC PKG_USER-AWPMD PKG_USER-BOCS PKG_USER-CGDNA PKG_USER-MESODPD PKG_USER-CGSDK PKG_USER-COLVARS
-CMAKE_ON+= PKG_USER-DIFFRACTION PKG_USER-DPD PKG_USER-DRUDE PKG_USER-EFF PKG_USER-FEP PKG_USER-LB
+CMAKE_ON+= PKG_USER-DIFFRACTION PKG_USER-DPD PKG_USER-DRUDE PKG_USER-EFF PKG_USER-FEP
CMAKE_ON+= PKG_USER-MANIFOLD PKG_USER-MEAMC PKG_USER-MGPT PKG_USER-MISC PKG_USER-MOFFF PKG_USER-MOLFILE
CMAKE_ON+= PKG_USER-PHONON PKG_USER-PTM PKG_USER-QTB PKG_USER-REACTION
CMAKE_ON+= PKG_USER-REAXC PKG_USER-SDPD PKG_USER-SMD PKG_USER-SMTBQ PKG_USER-SPH PKG_USER-TALLY
CMAKE_ON+= PKG_USER-UEF PKG_USER-QMMM PKG_USER-YAFF
-# Packages requiring extra downloades or dependencies: PKG_MSCG PKG_USER-ADIOS2 PKG_USER-NETCDF PKG_USER-QUIP PKG_USER-PLUMED PKG_USER-SCAFACOS
+# Packages requiring extra downloades or dependencies: PKG_MSCG PKG_USER-ADIOS2 PKG_USER-NETCDF PKG_USER-QUIP PKG_USER-SCAFACOS
OPTIONS_DEFINE= JPEG PNG GZIP FFMPEG
OPTIONS_GROUP= PARALLEL PACKAGES
-OPTIONS_DEFAULT= MPI OPENMP JPEG PNG GZIP FFMPEG H5MD KOKKOS VORONOI KIM LATTE ${OPTIONS_DEFAULT_${CHOSEN_COMPILER_TYPE}}
+OPTIONS_DEFAULT= MPI OPENMP JPEG PNG GZIP FFMPEG H5MD KIM KOKKOS LATTE PLUMED VORONOI ${OPTIONS_DEFAULT_${CHOSEN_COMPILER_TYPE}}
OPTIONS_SUB= yes
PARALLEL_DESC= Enable parallelizations:
PACKAGES_DESC= Enable packages:
OPTIONS_GROUP_PARALLEL= MPI OPENMP ${OPTIONS_DEFINE_${CHOSEN_COMPILER_TYPE}}
-OPTIONS_GROUP_PACKAGES= H5MD KOKKOS VORONOI KIM LATTE VTK
+OPTIONS_GROUP_PACKAGES= H5MD KIM KOKKOS LATTE PLUMED VORONOI VTK
-MPI_CMAKE_BOOL= BUILD_MPI PKG_MPIIO
+MPI_CMAKE_BOOL= BUILD_MPI PKG_MPIIO PKG_USER-LB
MPI_LIB_DEPENDS= libmpi.so:net/openmpi
MPI_USES= compiler:c11
+FFMPEG_CMAKE_BOOL= WITH_FFMPEG
FFMPEG_BUILD_DEPENDS= ffmpeg:multimedia/ffmpeg
FFMPEG_RUN_DEPENDS= ffmpeg:multimedia/ffmpeg
@@ -73,21 +74,11 @@ PNG_LIB_DEPENDS= libpng.so:graphics/png
GZIP_DESC= Enable GZIP support
GZIP_CMAKE_BOOL= WITH_GZIP
-FFMPEG_CMAKE_BOOL= WITH_FFMPEG
-
H5MD_DESC= USER-H5MD package based on libhdf5
H5MD_CMAKE_BOOL= PKG_USER-H5MD
H5MD_LIB_DEPENDS= libhdf5.so:science/hdf5 \
libsz.so:science/szip
-KOKKOS_DESC= kokkos package based on the libkokkos library
-KOKKOS_CMAKE_BOOL= PKG_KOKKOS EXTERNAL_KOKKOS
-KOKKOS_LIB_DEPENDS= libkokkoscore.so:devel/kokkos
-
-VORONOI_DESC= voro++, Voronoi tessellation package
-VORONOI_CMAKE_BOOL= PKG_VORONOI
-VORONOI_LIB_DEPENDS= libvoro++.so:science/voro++
-
KIM_DESC= KIM package based on the OpenKim library/repository
KIM_USES= pkgconfig
KIM_CMAKE_BOOL= PKG_KIM
@@ -96,10 +87,24 @@ KIM_LIB_DEPENDS= libkim-api.so:science/kim-api \
libcurl.so:ftp/curl
KIM_RUN_DEPENDS= openkim-models>0:science/openkim-models
+KOKKOS_DESC= kokkos package based on the libkokkos library
+KOKKOS_CMAKE_BOOL= PKG_KOKKOS EXTERNAL_KOKKOS
+KOKKOS_LIB_DEPENDS= libkokkoscore.so:devel/kokkos
+
LATTE_DESC= latte package based on the liblatte library
LATTE_CMAKE_BOOL= PKG_LATTE
LATTE_LIB_DEPENDS= liblatte.so:science/latte
+PLUMED_DESC= plumed package based on the plumed library
+PLUMED_USES= pkgconfig
+PLUMED_CMAKE_BOOL= PKG_USER-PLUMED
+PLUMED_CMAKE_ON= -DPLUMED_MODE=shared
+PLUMED_LIB_DEPENDS= libplumed.so:science/plumed
+
+VORONOI_DESC= voro++, Voronoi tessellation package
+VORONOI_CMAKE_BOOL= PKG_VORONOI
+VORONOI_LIB_DEPENDS= libvoro++.so:science/voro++
+
VTK_DESC= USER-VTK package based on the external vtk package
VTK_CMAKE_BOOL= PKG_USER-VTK
VTK_CMAKE_ON= -DVTK_DIR:PATH=${LOCALBASE}/lib/vtk-8.2/cmake/vtk-8.2