sync/ports
1
0
Fork 0
mirror of https://git.freebsd.org/ports.git synced 2025-04-28 09:36:41 -04:00
Code Issues Projects Releases Packages Wiki Activity Actions

science/py-pymatgen: update 2024.11.13 → 2025.1.23

Browse source 
Reported by:	portscout
This commit is contained in:
Yuri Victorovich 2025-01-24 00:46:28 -08:00
parent a6e556497b
commit cdb84f1ab2
2 changed files with 23 additions and 10 deletions
Show stats Download patch file Download diff file Expand all files Collapse all files

27
science/py-pymatgen/Makefile
View file

@ -1,6 +1,6 @@
PORTNAME= pymatgen
DISTVERSIONPREFIX= v
DISTVERSION= 2024.11.13
DISTVERSION= 2025.1.23
CATEGORIES= science python
#MASTER_SITES= PYPI # no tests
PKGNAMEPREFIX= ${PYTHON_PKGNAMEPREFIX}
@ -18,7 +18,7 @@ BUILD_DEPENDS= ${PYNUMPY} \
RUN_DEPENDS= ${PYTHON_PKGNAMEPREFIX}beautifulsoup>0:www/py-beautifulsoup@${PY_FLAVOR} \
${PYTHON_PKGNAMEPREFIX}joblib>=1:devel/py-joblib@${PY_FLAVOR} \
${PYTHON_PKGNAMEPREFIX}matplotlib>=3.8:math/py-matplotlib@${PY_FLAVOR} \
${PYTHON_PKGNAMEPREFIX}monty>=2024.10.21:devel/py-monty@${PY_FLAVOR} \
${PYTHON_PKGNAMEPREFIX}monty>=2025.1.9:devel/py-monty@${PY_FLAVOR} \
${PYTHON_PKGNAMEPREFIX}networkx>=2.7:math/py-networkx@${PY_FLAVOR} \
${PYNUMPY} \
${PYTHON_PKGNAMEPREFIX}palettable>=3.3.3:misc/py-palettable@${PY_FLAVOR} \
@ -28,7 +28,6 @@ RUN_DEPENDS= ${PYTHON_PKGNAMEPREFIX}beautifulsoup>0:www/py-beautifulsoup@${PY_FL
${PYTHON_PKGNAMEPREFIX}requests>=2.32:www/py-requests@${PY_FLAVOR} \
${PYTHON_PKGNAMEPREFIX}ruamel.yaml>=0.17.0:devel/py-ruamel.yaml@${PY_FLAVOR} \
${PYTHON_PKGNAMEPREFIX}scipy>=1.13.0:science/py-scipy@${PY_FLAVOR} \
${PYTHON_PKGNAMEPREFIX}scipy>=1.14.1:science/py-scipy@${PY_FLAVOR} \
${PYTHON_PKGNAMEPREFIX}spglib>=2.5.0:science/py-spglib@${PY_FLAVOR} \
${PYTHON_PKGNAMEPREFIX}sympy>=1.3:math/py-sympy@${PY_FLAVOR} \
${PYTHON_PKGNAMEPREFIX}tabulate>=0.9:devel/py-tabulate@${PY_FLAVOR} \
@ -42,7 +41,10 @@ USE_PYTHON= pep517 cython concurrent autoplist pytest
USE_GITHUB= yes
GH_ACCOUNT= materialsproject
TEST_ENV= ${MAKE_ENV} PYTHONPATH=${STAGEDIR}${PYTHONPREFIX_SITELIBDIR}
TEST_ENV= ${MAKE_ENV} PYTHONPATH=${STAGEDIR}${PYTHONPREFIX_SITELIBDIR} \
PMG_TEST_FILES_DIR=${WRKSRC}/tests/files \
DISPLAY=${DISPLAY} \
XAUTHORITY=${XAUTHORITY}
TEST_WRKSRC= ${WRKSRC}/tests
post-install: # strip binaries
@ -51,8 +53,19 @@ post-install: # strip binaries
optimization/neighbors*.so \
util/coord_cython*.so
# tests fail to find some files: https://github.com/materialsproject/pymatgen/issues/4172
xpre-test:
@cd ${TEST_WRKSRC} && ${PYTHON_CMD} ${PYSETUP} build_ext --inplace
#tests as of 2025.1.23:
# Results (4206.00s (1:10:05)):
# 2743 passed
# 9 failed
# - tests/analysis/test_chempot_diagram.py:71 TestChemicalPotentialDiagram.test_pca
# - tests/cli/test_pmg_analyze.py:13 test_pmg_analyze
# - tests/cli/test_pmg_diff.py:12 test_pmg_diff
# - tests/cli/test_pmg_plot.py:15 test_plot_xrd
# - tests/cli/test_pmg_plot.py:31 test_plot_dos
# - tests/cli/test_pmg_plot.py:47 test_plot_chgint
# - tests/cli/test_pmg_plot.py:63 test_plot_wrong_arg
# - tests/cli/test_pmg_structure.py:13 test_pmg_structure
# - tests/core/test_structure.py:1770 TestStructure.test_charge
# 194 skipped
.include <bsd.port.mk>

6
science/py-pymatgen/distinfo
View file

@ -1,3 +1,3 @@
TIMESTAMP = 1731622067
SHA256 (materialsproject-pymatgen-v2024.11.13_GH0.tar.gz) = b780cc395007f5793d1823d4b0b83ed99cfec10d4834bb8e640e92c65627dbe5
SIZE (materialsproject-pymatgen-v2024.11.13_GH0.tar.gz) = 262224927
TIMESTAMP = 1737700626
SHA256 (materialsproject-pymatgen-v2025.1.23_GH0.tar.gz) = 68eafa7d148119a3aa739fd514f9f9cecfb03b316e41f29d3f87a84bb4872670
SIZE (materialsproject-pymatgen-v2025.1.23_GH0.tar.gz) = 262615770