svn commit: r487700 - head/science/mpqc
Yuri Victorovich
yuri at FreeBSD.org
Mon Dec 17 18:13:19 UTC 2018
Author: yuri
Date: Mon Dec 17 18:13:17 2018
New Revision: 487700
URL: https://svnweb.freebsd.org/changeset/ports/487700
Log:
science/mpqc: Change net/mpich2 -> net/mpich
Other port changes:
* Add the graphviz dependency
* Patch one #include that isn't found by default for some reason
* Fix WWW
Modified:
head/science/mpqc/Makefile
head/science/mpqc/pkg-descr
Modified: head/science/mpqc/Makefile
==============================================================================
--- head/science/mpqc/Makefile Mon Dec 17 17:51:21 2018 (r487699)
+++ head/science/mpqc/Makefile Mon Dec 17 18:13:17 2018 (r487700)
@@ -3,7 +3,7 @@
PORTNAME= mpqc
PORTVERSION= 2.3.1
-PORTREVISION= 40
+PORTREVISION= 41
CATEGORIES= science parallel
MASTER_SITES= SF
@@ -15,8 +15,10 @@ LICENSE_FILE= ${WRKSRC}/COPYING
BROKEN_aarch64= fails to compile: lapack.h:2:10: 'chemistry/qc/mbptr12/f77sym.h' file not found
+BUILD_DEPENDS= dot:graphics/graphviz
LIB_DEPENDS= libint.so:science/libint
-RUN_DEPENDS= wish:x11-toolkits/tk-wrapper
+RUN_DEPENDS= wish:x11-toolkits/tk-wrapper \
+ dot:graphics/graphviz
CONFLICTS_BUILD= ga # devel/ga: it links to libarmci.so, has HAVE_ARMCI defined, and hits some bug
@@ -49,7 +51,7 @@ DOXYGEN_BUILD_DEPENDS= doxygen:devel/doxygen \
dot:graphics/graphviz
ICC_BUILD_DEPENDS= ${LOCALBASE}/intel_cc_80/bin/icc:lang/icc
MPI_CONFIGURE_ENABLE= parallel
-MPI_LIB_DEPENDS= libmpich.so:net/mpich2
+MPI_LIB_DEPENDS= libmpich.so:net/mpich
MPI_LDFLAGS= -lmpich # build fails to supply libmpich.so to link
OPTIFLAGS_CFLAGS= -ffast-math
OPTIFLAGS_CXXFLAGS= -ffast-math
@@ -70,6 +72,10 @@ post-patch:
-e 's/pthread_join(0,0)/pthread_create(0,0,0,0)/' \
-e 's|/usr/bin/wish|${LOCALBASE}/bin/wish|' \
${WRKSRC}/configure
+ @${REINPLACE_CMD} \
+ 's|#include <chemistry/qc/mbptr12/f77sym.h>|#include <${WRKSRC}/src/lib/chemistry/qc/mbptr12/f77sym.h>|' \
+ ${WRKSRC}/src/lib/chemistry/qc/mbptr12/blas.h \
+ ${WRKSRC}/src/lib/chemistry/qc/mbptr12/lapack.h
post-configure: # workaround: https://github.com/ValeevGroup/mpqc/issues/56
@${REINPLACE_CMD} -e ' \
Modified: head/science/mpqc/pkg-descr
==============================================================================
--- head/science/mpqc/pkg-descr Mon Dec 17 17:51:21 2018 (r487699)
+++ head/science/mpqc/pkg-descr Mon Dec 17 18:13:17 2018 (r487700)
@@ -30,4 +30,4 @@ You can also validate your mpqc binaries when you empl
For details, please see file:///usr/local/share/doc/mpqc/hierarchy.html
or http://www.mpqc.org/mpqc-html/mpqcval.html
-WWW: https://www.mpqc.org/
+WWW: https://mpqc.org/
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