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science/{,py-}dftd4: update 3.5.0 → 3.6.0 

PR:	278516
main
Andrey Korobkov 2024-04-21 15:18:17 -07:00 committed by Yuri Victorovich
parent de9614f8a5
commit 4280c24ced
5 changed files with 12 additions and 15 deletions
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7
science/dftd4/Makefile
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@ -1,17 +1,16 @@
PORTNAME= dftd4
DISTVERSIONPREFIX= v
DISTVERSION= 3.5.0
PORTREVISION= 1
DISTVERSION= 3.6.0
CATEGORIES= science # chemistry
MAINTAINER= yuri@FreeBSD.org
COMMENT= Atomic-charge dependent london dispersion correction computation
WWW= https://www.chemie.uni-bonn.de/pctc/mulliken-center/software/dftd4
WWW= https://www.chemie.uni-bonn.de/pctc/mulliken-center/software/dftd4/
LICENSE= GPLv3
LICENSE_FILE= ${WRKSRC}/COPYING
BROKEN_aarch64= Cannot open module file 'ieee_arithmetic.mod' for reading at (1): No such file or directory
BROKEN_aarch64= cannot open module file 'ieee_arithmetic.mod' for reading at (1): No such file or directory
BUILD_DEPENDS= mstore>0:science/mstore
LIB_DEPENDS= libmctc-lib.so:science/mctc-lib \

6
science/dftd4/distinfo
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@ -1,3 +1,3 @@
TIMESTAMP = 1687112697
SHA256 (dftd4-dftd4-v3.5.0_GH0.tar.gz) = 69830a32be61e683f3246239bdbf6a5ab8a0c902c76716f215262d16082a9e6d
SIZE (dftd4-dftd4-v3.5.0_GH0.tar.gz) = 355248
TIMESTAMP = 1713733317
SHA256 (dftd4-dftd4-v3.6.0_GH0.tar.gz) = 0e3e8d5f9e9e5414b9979967c074c953706053832e551d922c27599e7324bace
SIZE (dftd4-dftd4-v3.6.0_GH0.tar.gz) = 355901

2
science/dftd4/pkg-plist
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@ -34,5 +34,5 @@ lib/cmake/dftd4/dftd4-targets.cmake
lib/cmake/dftd4/dftd4-utils.cmake
lib/libdftd4.so
lib/libdftd4.so.3
lib/libdftd4.so.3.5.0
lib/libdftd4.so.3.6.0
libdata/pkgconfig/dftd4.pc

6
science/py-dftd4/Makefile
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@ -1,18 +1,16 @@
PORTNAME= dftd4
DISTVERSION= 3.5.0
DISTVERSION= 3.6.0
CATEGORIES= science python # chemistry
MASTER_SITES= PYPI
PKGNAMEPREFIX= ${PYTHON_PKGNAMEPREFIX}
MAINTAINER= yuri@FreeBSD.org
COMMENT= Python API of the DFT-D4 project
WWW= https://www.chemie.uni-bonn.de/pctc/mulliken-center/software/dftd4
WWW= https://www.chemie.uni-bonn.de/pctc/mulliken-center/software/dftd4/
LICENSE= GPLv3
LICENSE_FILE= ${WRKSRC}/COPYING
BROKEN= build fails: meson-python: error ... after devel/meson-python update to 0.13.2, see https://github.com/dftd4/dftd4/issues/212
BUILD_DEPENDS= ${PYTHON_PKGNAMEPREFIX}cffi>0:devel/py-cffi@${PY_FLAVOR} \
${PYTHON_PKGNAMEPREFIX}meson-python>0:devel/meson-python@${PY_FLAVOR} \
${PYTHON_PKGNAMEPREFIX}wheel>0:devel/py-wheel@${PY_FLAVOR}

6
science/py-dftd4/distinfo
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@ -1,3 +1,3 @@
TIMESTAMP = 1691044768
SHA256 (dftd4-3.5.0.tar.gz) = 4f4cd5c611da558756095b34675cb038192baaae44fd7537e22676742f2f79dd
SIZE (dftd4-3.5.0.tar.gz) = 495370
TIMESTAMP = 1713733814
SHA256 (dftd4-3.6.0.tar.gz) = 95866afebdd0762bcd2e1c031e42f48ba99483d12ed45d34afd6bc3667445adb
SIZE (dftd4-3.6.0.tar.gz) = 495952