svn commit: r482133 - in head/science/gamess-us: . files
Yuri Victorovich
yuri at FreeBSD.org
Mon Oct 15 06:12:05 UTC 2018
Author: yuri
Date: Mon Oct 15 06:12:03 2018
New Revision: 482133
URL: https://svnweb.freebsd.org/changeset/ports/482133
Log:
science/gamess-us: Cosmetic change: internal version number change to 00 for convenence because it is a default
Modified:
head/science/gamess-us/Makefile
head/science/gamess-us/files/pkg-message.in
Modified: head/science/gamess-us/Makefile
==============================================================================
--- head/science/gamess-us/Makefile Mon Oct 15 05:30:04 2018 (r482132)
+++ head/science/gamess-us/Makefile Mon Oct 15 06:12:03 2018 (r482133)
@@ -2,7 +2,7 @@
PORTNAME= gamess
DISTVERSION= 20181013
-PORTREVISION= 1
+PORTREVISION= 2
CATEGORIES= science
PKGNAMESUFFIX= -us # "US" fork
DISTNAME= gamess-current
@@ -25,7 +25,7 @@ WRKSRC= ${WRKDIR}/gamess
BINARY_ALIAS= gcc=${CC} gfortran=gfortran${GCC_DEFAULT}
-GAMES_VERNO= 01
+GAMES_VERNO= 00
GAMES_ENV= GMS_PATH=${WRKSRC} GMS_BUILD_DIR=${WRKSRC} GMS_TARGET=${ARCH:S/amd64/linux64/:S/i386/linux32/} \
GMS_FORTRAN=gfortran GMS_GFORTRAN_VERNO=7.3 \
GMS_VERSION=${GAMES_VERNO} GMS_BUILD_PATH=${WRKSRC} \
@@ -68,7 +68,7 @@ do-configure:
do-build:
@cd ${WRKSRC}/ddi && ${SETENV} ${MAKE_ENV} ./compddi && ${MV} ddikick.x ..
@cd ${WRKSRC} && ${SETENV} ${MAKE_ENV} ./compall
- @cd ${WRKSRC} && ${SETENV} ${MAKE_ENV} ./lked gamess 01
+ @cd ${WRKSRC} && ${SETENV} ${MAKE_ENV} ./lked gamess ${GAMES_VERNO}
do-install:
${INSTALL_SCRIPT} ${WRKSRC}/rungms ${STAGEDIR}${PREFIX}/bin
Modified: head/science/gamess-us/files/pkg-message.in
==============================================================================
--- head/science/gamess-us/files/pkg-message.in Mon Oct 15 05:30:04 2018 (r482132)
+++ head/science/gamess-us/files/pkg-message.in Mon Oct 15 06:12:03 2018 (r482133)
@@ -4,7 +4,12 @@ You installed GAMESS (US): General Atomic and Molecula
In order to run the computation, run the command:
$ rungms {case-name} %%GAMES_VERNO%% {num-cpu}
+or its simplified form:
+$ rungms {case-name}
It expects the input file {case-name}.inp which specifies the
computation to perform.
+
+You can use the wxmacmolplt command from science/wxmacmolplt to view
+the computation results.
======================================================================
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