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| author | yuri <yuri@FreeBSD.org> | 2018-09-14 11:10:59 +0800 |
|---|---|---|
| committer | yuri <yuri@FreeBSD.org> | 2018-09-14 11:10:59 +0800 |
| commit | d6bc90dbd7b7bc979bf88037f04a1a46e8ca3c9c (patch) | |
| tree | 7e402c159d0199596d45899c2b782e77f2bcd276 | |
| parent | d82a17e38959531a5ebb65146c10b7065998040b (diff) | |
| download | freebsd-ports-gnome-d6bc90dbd7b7bc979bf88037f04a1a46e8ca3c9c.tar.gz freebsd-ports-gnome-d6bc90dbd7b7bc979bf88037f04a1a46e8ca3c9c.tar.zst freebsd-ports-gnome-d6bc90dbd7b7bc979bf88037f04a1a46e8ca3c9c.zip | |
New port: science/py-molmod: Collection of molecular modelling tools for python
| -rw-r--r-- | science/Makefile | 1 | ||||
| -rw-r--r-- | science/py-molmod/Makefile | 28 | ||||
| -rw-r--r-- | science/py-molmod/distinfo | 3 | ||||
| -rw-r--r-- | science/py-molmod/pkg-descr | 4 |
4 files changed, 36 insertions, 0 deletions
diff --git a/science/Makefile b/science/Makefile index ace772c91dec..6c03b6cbab4d 100644 --- a/science/Makefile +++ b/science/Makefile @@ -209,6 +209,7 @@ SUBDIR += py-mdp SUBDIR += py-mlpy SUBDIR += py-mmtf-python + SUBDIR += py-molmod SUBDIR += py-netCDF4 SUBDIR += py-obspy SUBDIR += py-openpiv diff --git a/science/py-molmod/Makefile b/science/py-molmod/Makefile new file mode 100644 index 000000000000..975c1fb89cf5 --- /dev/null +++ b/science/py-molmod/Makefile @@ -0,0 +1,28 @@ +# $FreeBSD$ + +PORTNAME= molmod +DISTVERSION= 1.4.4 +CATEGORIES= science python +MASTER_SITES= CHEESESHOP +PKGNAMEPREFIX= ${PYTHON_PKGNAMEPREFIX} + +MAINTAINER= yuri@FreeBSD.org +COMMENT= Collection of molecular modelling tools for python + +LICENSE= GPLv3+ +LICENSE_FILE= ${WRKSRC}/LICENSE.txt + +BUILD_DEPENDS= ${PYNUMPY} +RUN_DEPENDS= ${PYNUMPY} \ + ${PYTHON_PKGNAMEPREFIX}future>=0:devel/py-future@${PY_FLAVOR} +TEST_DEPENDS= ${PYTHON_PKGNAMEPREFIX}nose>=0:devel/py-nose@${PY_FLAVOR} + +USES= python shebangfix +SHEBANG_GLOB= *.py +USE_PYTHON= distutils cython cython_run autoplist + +do-test: # Tests fail: https://github.com/molmod/molmod/issues/27 + @cd ${WRKSRC} && \ + ${SETENV} ${MAKE_ENV} nosetests-${PYTHON_VER} -v molmod + +.include <bsd.port.mk> diff --git a/science/py-molmod/distinfo b/science/py-molmod/distinfo new file mode 100644 index 000000000000..3a3f259cad29 --- /dev/null +++ b/science/py-molmod/distinfo @@ -0,0 +1,3 @@ +TIMESTAMP = 1536893478 +SHA256 (molmod-1.4.4.tar.gz) = ca0e461fe42fc8b7e0b481cda33aac247d86b5fb817b5076e20abc90dd577797 +SIZE (molmod-1.4.4.tar.gz) = 1692687 diff --git a/science/py-molmod/pkg-descr b/science/py-molmod/pkg-descr new file mode 100644 index 000000000000..391394ea753e --- /dev/null +++ b/science/py-molmod/pkg-descr @@ -0,0 +1,4 @@ +MolMod is a collection of molecular modelling tools for python. It is used by +other software developed at the CMM, including Yaff, TAMkin and Zeobuilder. + +WWW: https://github.com/molmod/molmod |