Date: Sat, 5 Aug 2023 18:49:58 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: 7f1f24a654ab - main - science/gcp: New port: Geometrical Counter-Poise Correction Message-ID: <202308051849.375Inw2Q059710@gitrepo.freebsd.org>
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The branch main has been updated by yuri: URL: https://cgit.FreeBSD.org/ports/commit/?id=7f1f24a654ab60264260f34888aed3e721f06a4f commit 7f1f24a654ab60264260f34888aed3e721f06a4f Author: Yuri Victorovich <yuri@FreeBSD.org> AuthorDate: 2023-08-05 18:38:40 +0000 Commit: Yuri Victorovich <yuri@FreeBSD.org> CommitDate: 2023-08-05 18:49:53 +0000 science/gcp: New port: Geometrical Counter-Poise Correction --- science/Makefile | 1 + science/gcp/Makefile | 28 ++++++++++++++++++++++++++++ science/gcp/distinfo | 7 +++++++ science/gcp/pkg-descr | 2 ++ 4 files changed, 38 insertions(+) diff --git a/science/Makefile b/science/Makefile index 7694032d6482..9d609cb9325d 100644 --- a/science/Makefile +++ b/science/Makefile @@ -103,6 +103,7 @@ SUBDIR += gamess-us SUBDIR += gbtolib SUBDIR += gchemutils + SUBDIR += gcp SUBDIR += gdma SUBDIR += geant4 SUBDIR += gemmi diff --git a/science/gcp/Makefile b/science/gcp/Makefile new file mode 100644 index 000000000000..8a960ff52dd6 --- /dev/null +++ b/science/gcp/Makefile @@ -0,0 +1,28 @@ +PORTNAME= gcp +DISTVERSIONPREFIX= v +DISTVERSION= 2.3.1 +CATEGORIES= science # chemistry + +MAINTAINER= yuri@FreeBSD.org +COMMENT= Geometrical Counter-Poise Correction +WWW= https://github.com/grimme-lab/gcp + +LICENSE= GPLv3 +LICENSE_FILE= ${WRKSRC}/COPYING + +USES= fortran meson +USE_LDCONFIG= yes + +USE_GITHUB= yes +GH_ACCOUNT= grimme-lab +GH_TUPLE= grimme-lab:mctc-lib:v0.2.0:mctc_lib/subprojects/mctc-lib \ + grimme-lab:mstore:v0.1.1:mstore/subprojects/mstore + +PLIST_FILES= bin/mctc-gcp \ + lib/libmctc-gcp.a \ + lib/libmctc-gcp.so \ + lib/libmctc-gcp.so.${DISTVERSION:R:R} \ + lib/libmctc-gcp.so.${DISTVERSION} \ + libdata/pkgconfig/mctc-gcp.pc + +.include <bsd.port.mk> diff --git a/science/gcp/distinfo b/science/gcp/distinfo new file mode 100644 index 000000000000..b039d732d540 --- /dev/null +++ b/science/gcp/distinfo @@ -0,0 +1,7 @@ +TIMESTAMP = 1691223464 +SHA256 (grimme-lab-gcp-v2.3.1_GH0.tar.gz) = 26c4d889062412c377459a4a939cbe12527dcdc5d89c99cf607f589ec86c5fe4 +SIZE (grimme-lab-gcp-v2.3.1_GH0.tar.gz) = 77416 +SHA256 (grimme-lab-mctc-lib-v0.2.0_GH0.tar.gz) = 4cd67dd9d9f0b757551470d66166603c6d28fedfaa883ef6f46e9257a4033ab6 +SIZE (grimme-lab-mctc-lib-v0.2.0_GH0.tar.gz) = 79860 +SHA256 (grimme-lab-mstore-v0.1.1_GH0.tar.gz) = 8a88979851558017361be653cf5b727118a972e6d2bd4ed839d9e5f12fa96c96 +SIZE (grimme-lab-mstore-v0.1.1_GH0.tar.gz) = 217871 diff --git a/science/gcp/pkg-descr b/science/gcp/pkg-descr new file mode 100644 index 000000000000..2f382bc095d9 --- /dev/null +++ b/science/gcp/pkg-descr @@ -0,0 +1,2 @@ +Geometrical Counter-Poise Correction +for quantum chemistry.
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