add rebuild for GROMACS and additional build dep

trz42 · May 15, 2024 · 72b9032 · 72b9032
1 parent fddacc6
commit 72b9032
Showing 1 changed file with 19 additions and 0 deletions.
diff --git a/...acks/pilot.nessi.no/2023.06/rebuilds/20240515-eb-4.9.1-GROMACS-correct-gmxapi-version.yml b/...acks/pilot.nessi.no/2023.06/rebuilds/20240515-eb-4.9.1-GROMACS-correct-gmxapi-version.yml
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+# 2024.05.15
+# Originally shipped version forgot to bump the gmxapi version and source
+# tarball, it was still using an older version from the 2023.3 tarball. Looking
+# at https://gitlab.com/gromacs/gromacs/-/blob/v2024.1/python_packaging/gmxapi/src/gmxapi/version.py?ref_type=tags#L68,
+# the 2024.1 release includes gmxapi 0.5.0.
+#
+# This also introduced a new build dependency on scikit-build-core for GROMACS
+#
+easyconfigs:
+  - scikit-build-core-0.9.3-GCCcore-13.2.0.eb:
+      options:
+        # from-commit: 61d07bff09afe63cfe1ae35dc58a0c8be01eed62
+        # see https://github.com/easybuilders/easybuild-easyconfigs/pull/20526
+        from-pr: 20526
+  - GROMACS-2024.1-foss-2023b.eb:
+      options:
+        # from-commit: a0a467a88506c765a93a96b20d7a8fcb01d46b24
+        # see https://github.com/easybuilders/easybuild-easyconfigs/pull/20522
+        from-pr: 20522