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-rw-r--r--science/psi3/Makefile16
1 files changed, 9 insertions, 7 deletions
diff --git a/science/psi3/Makefile b/science/psi3/Makefile
index 34c2efe626fa..20bb9802b7be 100644
--- a/science/psi3/Makefile
+++ b/science/psi3/Makefile
@@ -6,8 +6,7 @@
#
PORTNAME= psi3
-PORTVERSION= 3.3.0
-PORTREVISION= 1
+PORTVERSION= 3.4.0
CATEGORIES= science
MASTER_SITES= ${MASTER_SITE_SOURCEFORGE} \
http://www.psicode.org/doc/:doc
@@ -32,12 +31,12 @@ USE_BLAS= atlas
. if ${USE_BLAS} == reference
LIB_DEPENDS+= blas.2:${PORTSDIR}/math/blas
-LIB_DEPENDS+= lapack.4:${PORTSDIR}/math/lapack
+LIB_DEPENDS+= lapack:${PORTSDIR}/math/lapack
BLAS= -lblas
LAPACK= -llapack
.elif ${USE_BLAS} == gotoblas
LIB_DEPENDS+= goto:${PORTSDIR}/math/gotoblas
-LIB_DEPENDS+= lapack.4:${PORTSDIR}/math/lapack
+LIB_DEPENDS+= lapack:${PORTSDIR}/math/lapack
BLAS= -lgotop
LAPACK= -lgotop -llapack
.elif ${USE_BLAS} == atlas
@@ -49,7 +48,6 @@ LAPACK= -lalapack_r
USE_BZIP2= yes
GNU_CONFIGURE= yes
USE_GMAKE= yes
-USE_AUTOTOOLS= autoconf:262
USE_FORTRAN= yes
CONFIGURE_ARGS= --with-cc=${CC} \
--with-cxx=${CXX} \
@@ -57,6 +55,7 @@ CONFIGURE_ARGS= --with-cc=${CC} \
--with-lapack="${LAPACK}" \
--with-blas="${BLAS}" \
--datadir=${PREFIX}/share/psi3 \
+ --docdir=${WRKSRC}/tmpdoc/ \
--with-libdirs="-L${LOCALBASE}/lib" \
--with-libs="-lcompat"
@@ -76,10 +75,11 @@ CXXFLAGS+= -mfancy-math-387
WRKSRC= ${WRKDIR}/${PORTNAME}
MAN1= ccenergy.1 cceom.1 cints.1 clag.1 cscf.1 dboc.1 detcas.1 \
detcasman.1 detci.1 geom.1 input.1 intder.1 mocube.1 mp2.1 mp2r12.1 \
- oeprop.1 optking.1 psi3.1 psiclean.1 stable.1 tocprint.1 transqt.1
+ nonbonded.1 oeprop.1 optking.1 psi3.1 psiclean.1 stable.1 tocprint.1 \
+ transqt.1
+
pre-configure:
@${ECHO} "You can optimize by setting WITH_OPTIMIZED_FLAGS=yes."
- @${REINPLACE_CMD} -e 's|%%TMPDOC%%|${WRKSRC}/tmpdoc|g ' ${WRKSRC}/configure.ac
@${REINPLACE_CMD} -e 's|%%PTHREAD_CFLAGS%%|${PTREAD_CFLAGS}|g ; \
s|%%PTHREAD_LIBS%%|${PTHREAD_LIBS}|g' ${WRKSRC}/src/bin/cints/Makefile.in
@${REINPLACE_CMD} -e 's|%%PTHREAD_CFLAGS%%|${PTREAD_CFLAGS}|g ; \
@@ -101,7 +101,9 @@ do-install:
@${INSTALL_DATA} ${DISTDIR}/${DIST_SUBDIR}/userman.pdf ${DOCSDIR}
@${INSTALL_DATA} ${DISTDIR}/${DIST_SUBDIR}/progman.pdf ${DOCSDIR}
.endif
+.if !defined(NOPORTEXAMPLES)
@${MKDIR} ${PREFIX}/share/examples/psi3
@${TAR} cf - -C ${WRKSRC}/tests . | ${TAR} xf - -C ${PREFIX}/share/examples/psi3
+.endif
.include <bsd.port.post.mk>