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authorYuri Victorovich <yuri@FreeBSD.org>2023-07-14 15:01:27 +0000
committerYuri Victorovich <yuri@FreeBSD.org>2023-07-14 18:40:17 +0000
commit095e7397ce69f96a5babaa8a2d4a0acb1db22cfe (patch)
tree8ac8d452ea27bbdafc3cefa633c3168877c9be0f
parenta4a9f75641c15079469454c885f94d7a01953695 (diff)
downloadports-095e7397ce69f96a5babaa8a2d4a0acb1db22cfe.tar.gz
ports-095e7397ce69f96a5babaa8a2d4a0acb1db22cfe.zip
science/psi4: Update 1.8 → 1.8.1
Reported by: portscout
-rw-r--r--science/psi4/Makefile26
-rw-r--r--science/psi4/distinfo6
2 files changed, 5 insertions, 27 deletions
diff --git a/science/psi4/Makefile b/science/psi4/Makefile
index a2ece2d973c0..aac33fa4c4e6 100644
--- a/science/psi4/Makefile
+++ b/science/psi4/Makefile
@@ -1,6 +1,6 @@
PORTNAME= psi4
DISTVERSIONPREFIX= v
-DISTVERSION= 1.8
+DISTVERSION= 1.8.1
CATEGORIES= science # quantum-chemistry
EXTRACT_ONLY= ${DISTNAME}${EXTRACT_SUFX}
@@ -72,29 +72,7 @@ do-install: # project fails to install itself into a stage directory due to a co
# psi4 sometimes fails to print its version: https://github.com/psi4/psi4/issues/2831
-do-test: # tests are generally broken, but virtually all individual tests pass separately
- # based on https://psicode.org/psi4manual/master/build_planning.html#faq-minutetests
- #@cd ${WRKSRC}/tests && ${SETENV} ${TEST_ENV} pytest # pytest-based tests fail, see https://github.com/psi4/psi4/issues/2802 https://github.com/psi4/psi4/issues/2830
-
- # samples as tests, this also fails down the line: https://github.com/psi4/psi4/issues/2803
- #@cd ${WRKSRC} && ( \
- # for f in $$(${FIND} samples/cc24 -name test.in | ${XARGS} dirname); do \
- # echo "===> runing test in $$f"; \
- # (cd $$f && ${SETENV} ${TEST_ENV} ${STAGEDIR}${PREFIX}/bin/psi4 test.in) \
- # done \
- #)
-
- # api tests
+do-test:
@cd ${WRKSRC}/tests/pytests && ${SETENV} ${TEST_ENV} pytest
- # cli tests
- #@cd ${WRKSRC}/tests && ( \
- # for f in $$(${FIND} . -name input.dat | ${XARGS} dirname); do \
- # echo "===> runing input.dat $$f"; \
- # (cd $$f && ${SETENV} ${TEST_ENV} ${STAGEDIR}${PREFIX}/bin/psi4 input.dat) \
- # done \
- #)
-
-# QCEngine fails while running some psi4 tests: https://github.com/MolSSI/QCEngine/issues/404
-
.include <bsd.port.mk>
diff --git a/science/psi4/distinfo b/science/psi4/distinfo
index 0e8ccb414997..b76aabd051d6 100644
--- a/science/psi4/distinfo
+++ b/science/psi4/distinfo
@@ -1,3 +1,3 @@
-TIMESTAMP = 1684424227
-SHA256 (psi4-psi4-v1.8_GH0.tar.gz) = 0e7a9ff4a93b2f405c4f82817fbbb6e55f3451cd16faa00ac2f773c50e4108cc
-SIZE (psi4-psi4-v1.8_GH0.tar.gz) = 45064462
+TIMESTAMP = 1689307382
+SHA256 (psi4-psi4-v1.8.1_GH0.tar.gz) = f1431a68fd67ae8c31fdb3a8c135061d148246b9687c80decdc1b7ad917fe80b
+SIZE (psi4-psi4-v1.8.1_GH0.tar.gz) = 45068690