128 commits

Author	SHA1	Message	Date
Ole Schütt	8e6715cef3	Docker: Add duration to test_performance.sh	2021-12-14 07:20:39 +01:00
Ole Schütt	b87748f425	benchmarks: Add RI-HFX_H2O-32.inp (Augustin Bussy)	2021-12-14 07:20:39 +01:00
Ole Schütt	9cea0ffd4a	Revive minimax_to_fortran_source.py	2021-11-17 15:22:35 +01:00
Ole Schütt	a1e222f0fb	Docker: Redirect build log in test_coverage.sh	2021-10-29 12:46:03 +02:00
Ole Schütt	8eae7e3658	regtesting: Fix OpenMPI compatibility	2021-10-28 18:55:38 +02:00
Ole Schütt	3a7db175b4	Dashboard: Retire farming test	2021-10-27 15:01:36 +02:00
Ole Schütt	545439e58c	Docker: Remove early adoption of do_regtest.py	2021-10-27 15:01:36 +02:00
Ole Schütt	7522f2590a	Docker: Switch Gromacs to use pkgconfig	2021-10-25 15:09:02 +02:00
Ole Schütt	4e2d5bf436	Docker: Exclude SIRIUS from farming test	2021-10-17 21:45:45 +02:00
Ole Schütt	6c79ea356f	Dashboard: Add Gromacs QM/MM test	2021-10-12 00:52:22 +02:00
Ole Schütt	cd42411d7c	benchmarks: Add diag_cu[72,144]_broy.inp (Marcella Iannuzzi)	2021-07-24 12:01:36 +02:00
Ole Schütt	f82eaf34a7	precommit: Check file properties of all files again	2021-07-24 12:01:25 +02:00
Ole Schütt	a05a6033f5	Docker: Use git checkout instead of reset	2021-07-05 14:30:20 +02:00
Ole Schütt	8fffeb4192	benchmarks: Add MQAE_single_node.inp (Holly Judge)	2021-06-26 10:42:27 +02:00
Ole Schütt	dbd2db90d7	Docker: Freeze version of mypy	2021-06-15 18:12:03 +02:00
Ole Schütt	d4a823054a	Regtests: Optimize TEST_DIRS order	2021-06-04 16:34:52 +02:00
Ole Schütt	23844a3ef0	Docker: Use new do_regtest.py for Cuda test	2021-06-04 16:34:52 +02:00
Ole Schütt	bbd158e2cc	regtesting: Add do_regtest.py	2021-06-04 16:34:52 +02:00
Ole Schütt	8ad318d5b7	COSMA: Switch to prefixed_pxgemm API and upgrade to v2.5.0	2021-05-27 11:19:42 +02:00
Ole Schütt	2703552915	benchmarks: Add GW_PBE_4benzene.inp (Jan Wilhelm)	2021-05-05 11:03:59 +02:00
Ole Schütt	94e92db828	Docker: Simplify test_python.sh, include mypy, and test dashboard	2021-04-10 08:48:57 +02:00
Ole Schütt	34810910c1	Docker: Add Cuda performance test	2021-03-22 18:59:10 +01:00
Ole Schütt	15149397e0	Docker: Exclude toolchain from coverage report	2021-03-20 15:50:51 +01:00
Ole Schütt	3359402a82	Docker: Remove test_scaling, it got replaced by test_performance	2021-03-11 21:23:57 +01:00
Ole Schütt	7e3e805948	Docker: Fix missing timings in plot_performance.py	2021-03-06 11:38:52 +01:00
Ole Schütt	f2d27513a6	Docker: Plot OpenMP timings individually instead of their ratio	2021-03-05 18:06:31 +01:00
Ole Schütt	3f85c3cb27	Docker: Add QS_single_node to performance test	2021-02-28 22:53:54 +01:00
Ole Schütt	a130d97bd8	Docker: Install golang for Python test	2021-02-23 19:33:33 +01:00
Ole Schütt	43a662790f	Docker: Add performance test	2021-02-18 21:03:28 +01:00
Ole Schütt	d59a3ad777	Format all shell scripts	2021-02-18 00:33:20 +01:00
Ole Schütt	e6bf21660f	Docker: Fix pdbg test	2021-01-28 18:11:28 +01:00
Ole Schütt	2d3b478bfe	Docker: Skip libvori/libbqb in farming test	2020-12-30 12:25:54 +01:00
Tiziano Müller	f213cf7155	docker: update lcov to 1.15 ... fixes #1217	2020-12-17 10:59:06 +01:00
Ole Schütt	3fa2b5a810	Docker: Add Debian support	2020-12-10 10:59:24 +01:00
Ole Schütt	3391e16178	Use tag instead of sha	2020-11-23 20:01:07 +01:00
Ole Schütt	4b86e7e9df	Docker: Pin DBCSR version for pdbg test	2020-11-23 20:01:07 +01:00
Ole Schütt	4e271ea1eb	Toolchain: Remove dependency on locales	2020-10-19 18:50:12 +02:00
Ole Schütt	d70bb55f0f	Revive Doxygen	2020-09-03 17:56:54 +02:00
Ole Schütt	c450851349	Dashboard/Docker: Remove formatting test	2020-08-31 12:59:48 +02:00
Tiziano Müller	7593782fc3	pre-commit: include clang-format	2020-08-25 15:09:58 +02:00
Tiziano Müller	ca7056daac	pre-commit: integrate markdownlint, format previously ignored files	2020-08-25 15:09:58 +02:00
Ole Schütt	d9a7f716b1	Docker: Fix ASE test	2020-08-12 11:37:47 +02:00
Ole Schütt	729dd9a743	Docker: Adopt to new path of ASE tests	2020-08-02 11:22:59 +02:00
Ole Schütt	70d158756f	Docker: Switch i-Pi test to Python3	2020-08-02 11:22:59 +02:00
Ole Schütt	283c0c5360	Docker: Improve error messages and comply with shellcheck	2020-07-10 22:50:35 +02:00
Ole Schütt	658a154aac	Docker: Run farming test with psmp and single thread	2020-07-09 15:51:57 +02:00
Ole Schütt	9176043516	Docker: Fix ASE test (was false positive for a while)	2020-07-06 23:40:14 +02:00
Ole Schütt	d44c842465	Docker: Switch test_farming to use pdbg	2020-06-12 17:11:15 +02:00
Ole Schütt	e15be0ade5	Docker: Remove popt from scaling test	2020-06-11 17:31:08 +02:00
Ole Schütt	720a9835fd	Move to Python3 - Part 2	2020-05-25 20:54:28 +02:00