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authorYuri Victorovich <yuri@FreeBSD.org>2022-11-15 05:39:46 +0000
committerYuri Victorovich <yuri@FreeBSD.org>2022-11-15 05:39:46 +0000
commite436f951d4b9e87fe2d6cc9d1b6a16140071f4ff (patch)
tree34881f08643bd76d72e8169d9d3dc5c55d993a7a
parent6a4b73e93107bb07cea010027698578a0ef09a4d (diff)
downloadports-e436f951d4b9e87fe2d6cc9d1b6a16140071f4ff.tar.gz
ports-e436f951d4b9e87fe2d6cc9d1b6a16140071f4ff.zip
science/py-qcengine: Correct test dependency
-rw-r--r--science/py-qcengine/Makefile4
1 files changed, 2 insertions, 2 deletions
diff --git a/science/py-qcengine/Makefile b/science/py-qcengine/Makefile
index 9cc06637eceb..fa9907a6c934 100644
--- a/science/py-qcengine/Makefile
+++ b/science/py-qcengine/Makefile
@@ -18,13 +18,13 @@ RUN_DEPENDS= ${PYTHON_PKGNAMEPREFIX}py-cpuinfo>0:sysutils/py-py-cpuinfo@${PY_FLA
${PYTHON_PKGNAMEPREFIX}yaml>0:devel/py-yaml@${PY_FLAVOR}
TEST_DEPENDS= ${PYTHON_PKGNAMEPREFIX}pytest>0:devel/py-pytest@${PY_FLAVOR} \
mopac:science/mopac \
- mrchem:science/${PYTHON_PKGNAMEPREFIX}mrchem \
+ mrchem:science/py-mrchem@${PY_FLAVOR} \
nwchem:science/nwchem \
rdkit>0:science/rdkit \
xtb:science/xtb \
${PYTHON_PKGNAMEPREFIX}pyberny>0:science/py-pyberny@${PY_FLAVOR} \
${PYTHON_PKGNAMEPREFIX}geometric>0:science/py-geometric@${PY_FLAVOR}
- # last dependencies above are for specific quantum chemistry packages to test with TODO torchani,mopac,openmm,psi4,torsiondrive,mdi
+ # last dependencies above are for specific quantum chemistry packages to test with TODO torchani,openmm,psi4,torsiondrive,mdi
USES= python:3.8+
USE_PYTHON= distutils concurrent autoplist pytest # 1 test fails, see https://github.com/MolSSI/QCEngine/issues/377