Date: Mon, 15 Oct 2018 06:12:04 +0000 (UTC) From: Yuri Victorovich <yuri@FreeBSD.org> To: ports-committers@freebsd.org, svn-ports-all@freebsd.org, svn-ports-head@freebsd.org Subject: svn commit: r482133 - in head/science/gamess-us: . files Message-ID: <201810150612.w9F6C4bs039059@repo.freebsd.org>
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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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