Date: Fri, 17 Jun 2022 17:05:34 GMT From: Yuri Victorovich <yuri@FreeBSD.org> To: ports-committers@FreeBSD.org, dev-commits-ports-all@FreeBSD.org, dev-commits-ports-main@FreeBSD.org Subject: git: 1508a7e9850a - main - science/gromacs: Update 2022.1 -> 2022.2 Message-ID: <202206171705.25HH5YMo006991@gitrepo.freebsd.org>
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The branch main has been updated by yuri: URL: https://cgit.FreeBSD.org/ports/commit/?id=1508a7e9850a2637c2aafc37d3a5d7a0e497c2f6 commit 1508a7e9850a2637c2aafc37d3a5d7a0e497c2f6 Author: Yuri Victorovich <yuri@FreeBSD.org> AuthorDate: 2022-06-17 17:03:55 +0000 Commit: Yuri Victorovich <yuri@FreeBSD.org> CommitDate: 2022-06-17 17:05:29 +0000 science/gromacs: Update 2022.1 -> 2022.2 Reported by: portscout --- science/gromacs/Makefile | 11 +++++++---- science/gromacs/distinfo | 6 +++--- science/gromacs/pkg-plist | 1 + 3 files changed, 11 insertions(+), 7 deletions(-) diff --git a/science/gromacs/Makefile b/science/gromacs/Makefile index 28a7df372742..1a89d9c50873 100644 --- a/science/gromacs/Makefile +++ b/science/gromacs/Makefile @@ -1,7 +1,7 @@ # Created by: Stephen Montgomery-Smith <stephen@math.missouri.edu> PORTNAME= gromacs -DISTVERSION= 2022.1 +DISTVERSION= 2022.2 CATEGORIES= science MASTER_SITES= ftp://ftp.gromacs.org/pub/gromacs/ @@ -16,13 +16,16 @@ BROKEN_i386= undefined reference to `__atomic_load' and `__atomic_compare_exchan BUILD_DEPENDS= boost-libs>=1.44:devel/boost-libs LIB_DEPENDS= libhwloc.so:devel/hwloc2 -USES= cmake compiler:c++17-lang fortran gnome perl5 pkgconfig shebangfix xorg +USES= cmake compiler:c++17-lang fortran gnome perl5 pkgconfig python:build shebangfix xorg +USE_GNOME= libxml2 +USE_LDCONFIG= yes + SHEBANG_FILES= admin/*.sh scripts/*.pl scripts/*.sh src/gromacs/selection/*.sh bash_CMD= ${SH} -USE_GNOME= libxml2 + CMAKE_OFF= GMX_USE_RDTSCP \ USE_PYTHON_SCRIPTS -USE_LDCONFIG= yes +CMAKE_ARGS= -DPython3_EXECUTABLE=${PYTHON_CMD} OPTIONS_DEFINE= ATLAS FLOAT LEGACY OPENCL OPENMP SIMD X11 OPTIONS_SINGLE= MP diff --git a/science/gromacs/distinfo b/science/gromacs/distinfo index fadfb2f4ed37..ab6f4ac2c311 100644 --- a/science/gromacs/distinfo +++ b/science/gromacs/distinfo @@ -1,3 +1,3 @@ -TIMESTAMP = 1651109042 -SHA256 (gromacs-2022.1.tar.gz) = 85ddab5197d79524a702c4959c2c43be875e0fc471df3a35224939dce8512450 -SIZE (gromacs-2022.1.tar.gz) = 40375423 +TIMESTAMP = 1655481665 +SHA256 (gromacs-2022.2.tar.gz) = 656404f884d2fa2244c97d2a5b92af148d0dbea94ad13004724b3fcbf45e01bf +SIZE (gromacs-2022.2.tar.gz) = 40350604 diff --git a/science/gromacs/pkg-plist b/science/gromacs/pkg-plist index 59bc52060add..950e48129744 100644 --- a/science/gromacs/pkg-plist +++ b/science/gromacs/pkg-plist @@ -43,6 +43,7 @@ include/gmxapi/version.h %%LEGACY%%include/gromacs/fileio/pdbio.h %%LEGACY%%include/gromacs/fileio/tpxio.h %%LEGACY%%include/gromacs/fileio/trxio.h +include/gromacs/libgromacs_export.h include/gromacs/math/do_fit.h include/gromacs/math/functions.h include/gromacs/math/units.h
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