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authorYuri Victorovich <yuri@FreeBSD.org>2022-10-23 06:19:54 +0000
committerYuri Victorovich <yuri@FreeBSD.org>2022-10-23 07:52:32 +0000
commite93e2de8ba1ca3245108e7be62c1dc97ec31bfd1 (patch)
treebafd141fe171a8221d0d6739a61e8b3a4882fc26 /science/py-chempy
parentfea5153b6c657d1e01ba17241c20f65a1aa64c9f (diff)
downloadports-e93e2de8ba1ca3245108e7be62c1dc97ec31bfd1.tar.gz
ports-e93e2de8ba1ca3245108e7be62c1dc97ec31bfd1.zip
science/py-chempy: Correct and add dependencies
Diffstat (limited to 'science/py-chempy')
-rw-r--r--science/py-chempy/Makefile37
1 files changed, 16 insertions, 21 deletions
diff --git a/science/py-chempy/Makefile b/science/py-chempy/Makefile
index 3974b69fbb29..a31810ade744 100644
--- a/science/py-chempy/Makefile
+++ b/science/py-chempy/Makefile
@@ -1,6 +1,7 @@
PORTNAME= chempy
DISTVERSION= 0.8.2
-CATEGORIES= science python
+PORTREVISION= 1
+CATEGORIES= science python # chemistry
MASTER_SITES= CHEESESHOP
PKGNAMEPREFIX= ${PYTHON_PKGNAMEPREFIX}
@@ -11,9 +12,9 @@ WWW= https://github.com/bjodah/chempy
LICENSE= BSD3CLAUSE
LICENSE_FILE= ${WRKSRC}/LICENSE
-PY_DEPENDS= \
- ${PYTHON_PKGNAMEPREFIX}dot2tex>=2.11.3:print/dot2tex@${PY_FLAVOR} \
+PY_DEPENDS= ${PYTHON_PKGNAMEPREFIX}dot2tex>=2.11.3:print/dot2tex@${PY_FLAVOR} \
${PYTHON_PKGNAMEPREFIX}matplotlib>=2.2.3:math/py-matplotlib@${PY_FLAVOR} \
+ ${PYNUMPY} \
${PYTHON_PKGNAMEPREFIX}PuLP>=1.6.8:math/py-PuLP@${PY_FLAVOR} \
${PYTHON_PKGNAMEPREFIX}pyneqsys>=0.5.5:math/py-pyneqsys@${PY_FLAVOR} \
${PYTHON_PKGNAMEPREFIX}pyodesys>=0.14.1:math/py-pyodesys@${PY_FLAVOR} \
@@ -21,26 +22,18 @@ PY_DEPENDS= \
${PYTHON_PKGNAMEPREFIX}quantities>=0.12.1:science/py-quantities@${PY_FLAVOR} \
${PYTHON_PKGNAMEPREFIX}scipy>=1.0.1:science/py-scipy@${PY_FLAVOR} \
${PYTHON_PKGNAMEPREFIX}sym>=0.3.4:math/py-sym@${PY_FLAVOR} \
- ${PYTHON_PKGNAMEPREFIX}sympy>=1.1.1:math/py-sympy@${PY_FLAVOR} \
- ${PYNUMPY}
+ ${PYTHON_PKGNAMEPREFIX}sympy>=1.1.1:math/py-sympy@${PY_FLAVOR}
BUILD_DEPENDS= ${PY_DEPENDS}
RUN_DEPENDS= ${PY_DEPENDS}
-TEST_DEPENDS= ${PYTHON_PKGNAMEPREFIX}pytest-cov>0:devel/py-pytest-cov@${PY_FLAVOR} \
+TEST_DEPENDS= ${PYTHON_PKGNAMEPREFIX}black>0:devel/py-black@${PY_FLAVOR} \
+ ${PYTHON_PKGNAMEPREFIX}pytest-cov>0:devel/py-pytest-cov@${PY_FLAVOR} \
${PYTHON_PKGNAMEPREFIX}pytest-flakes>0:devel/py-pytest-flakes@${PY_FLAVOR}
-USES= python:3.7+ pytest
-USE_PYTHON= distutils autoplist
+USES= python:3.8+
+USE_PYTHON= distutils autoplist pytest
NO_ARCH= yes
-# https://github.com/bjodah/chempy/issues/198
-PYTEST_BROKEN_TESTS= test_get_native__a_substance_no_composition \
- test_balance_stoichiometry__underdetermined \
- test_balance_stoichiometry__very_underdetermined \
- test_balance_stoichiometry__underdetermined__canoncial \
- test_balance_stoichiometry__substances__underdetermined \
- test_balance_stoichiometry__duplicates
-
CONFLICTS_INSTALL= ${PYTHON_PKGNAMEPREFIX}pymol # https://github.com/schrodinger/pymol-open-source/issues/100
OPTIONS_DEFINE= EXTRAS
@@ -48,10 +41,12 @@ OPTIONS_DEFAULT= EXTRAS
EXTRAS_DESC= Install optional dependencies for additional functionality
EXTRAS_RUN_DEPENDS= ${PYTHON_PKGNAMEPREFIX}appdirs>0:devel/py-appdirs@${PY_FLAVOR} \
- ${PYTHON_PKGNAMEPREFIX}bokeh>=0.11.1:www/py-bokeh@${PY_FLAVOR} \
- ${PYTHON_PKGNAMEPREFIX}pycodeexport>=0.1.2:devel/py-pycodeexport@${PY_FLAVOR} \
- ${PYTHON_PKGNAMEPREFIX}pycompilation>=0.4.3:devel/py-pycompilation@${PY_FLAVOR} \
- ${PYTHON_PKGNAMEPREFIX}pygslodeiv2>=0.9.1:math/py-pygslodeiv2@${PY_FLAVOR} \
- ${PYTHON_PKGNAMEPREFIX}pyodeint>=0.10.1:math/py-pyodeint@${PY_FLAVOR}
+ ${PYTHON_PKGNAMEPREFIX}bokeh>=0.13.0:www/py-bokeh@${PY_FLAVOR} \
+ ${PYTHON_PKGNAMEPREFIX}ipywidgets>0:devel/py-ipywidgets@${PY_FLAVOR} \
+ ${PYTHON_PKGNAMEPREFIX}pycodeexport>=0.1.3:devel/py-pycodeexport@${PY_FLAVOR} \
+ ${PYTHON_PKGNAMEPREFIX}pycompilation>=0.4.12:devel/py-pycompilation@${PY_FLAVOR} \
+ ${PYTHON_PKGNAMEPREFIX}pygslodeiv2>=0.9.4:math/py-pygslodeiv2@${PY_FLAVOR} \
+ ${PYTHON_PKGNAMEPREFIX}pyodeint>=0.10.4:math/py-pyodeint@${PY_FLAVOR}
+ # TODO pycvodes>=0.14.0, pykinsol>=0.1.6
.include <bsd.port.mk>