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13 commits

Author SHA1 Message Date
Dynamics of Condensed Matter
52b5bac6eb
Test installed CP2K CMake package config (#5231) 
Co-authored-by: Thomas D. Kuehne <tkuehne@cp2k.org>
 2026-05-18 09:08:48 +02:00
Ole Schütt
665dafcec4 Docker: Simplify generate_dockerfiles.py 2025-07-24 15:48:42 +02:00
Matthias Krack
64419ea128 Fix (stabilize) Gromacs test 2025-07-10 11:22:33 +02:00
Matthias Krack
349f45176d Update profile name of 3rd party tests due to #4134 2025-04-12 13:26:51 +02:00
Ole Schütt
83b56453e7 Docker: Move 3rd party tests to toolchain as they need libxc 2025-02-02 13:18:58 +01:00
Ole Schütt
c5411e048c Docker: Migrate ssmp test to CMake 2024-05-15 13:28:13 +02:00
Ole Schütt
f30e229226 Docker: Migrate ASE, AiiDA, i-PI, and Gromacs tests to CMake 2024-05-10 14:01:57 +02:00
Ole Schütt
47e8414d44 Docker: Copy logs into artifacts after failure 2023-12-12 18:09:04 +01:00
Ole Schütt
9ec910f202 Docker: Switch Gromacs branch master -> main 2022-05-19 20:05:19 +02:00
Ole Schütt
e861a83b17 Docker: Move install dir to /opt/cp2k 2022-03-11 17:12:55 +01:00
Ole Schütt
f2768158e7 Docker: User build context for all images 2022-02-24 19:11:59 +01:00
Ole Schütt
7522f2590a Docker: Switch Gromacs to use pkgconfig 2021-10-25 15:09:02 +02:00
Ole Schütt
6c79ea356f Dashboard: Add Gromacs QM/MM test 2021-10-12 00:52:22 +02:00