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{2023.06}[2023a] acpype v2023.10.27 #1332

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Merged
Neves-P merged 9 commits into from
Feb 11, 2026
Merged

{2023.06}[2023a] acpype v2023.10.27 #1332

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8b95ff2
Add `acpype` to `foss/2023a`
Crivella Dec 11, 2025
34b613a
Move to latest commit in PR
Crivella Jan 27, 2026
4ca6d02
Update easystacks/software.eessi.io/2023.06/eessi-2023.06-eb-5.2.0-20…
Crivella Jan 27, 2026
ccc20db
Add fix for AmberTools on arm systems
Crivella Jan 30, 2026
a9158f4
Merge branch 'main' into feature-acpype
ocaisa Feb 5, 2026
744c0eb
Add fix for building OpenBabel on non-x86 systems
Crivella Feb 5, 2026
0060367
Updated to latest commit for OpenBabel
Crivella Feb 7, 2026
3c46488
Merge branch 'main' into feature-acpype
Crivella Feb 7, 2026
21129ac
Merge branch 'main' into feature-acpype
ocaisa Feb 10, 2026
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11 changes: 11 additions & 0 deletions easystacks/software.eessi.io/2023.06/eessi-2023.06-eb-5.2.0-2023a.yml
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Expand Up @@ -12,3 +12,14 @@ easyconfigs:
options:
# see https://github.com/easybuilders/easybuild-easyconfigs/pull/25113
from-commit: 077b656e7e9a93aef4a6286aafc57fb5acd7a424
- AmberTools-23.6-foss-2023a.eb:
options:
# see https://github.com/easybuilders/easybuild-easyblocks/pull/4045
include-easyblocks-from-commit: b0aef6d87f3b102a29f53c875e1c69b789f16a33
# see https://github.com/easybuilders/easybuild-easyconfigs/pull/25193
from-commit: f97ac13b2d4290c505aaa6532fdedebb4f629834
- OpenBabel-3.1.1-gompi-2023a.eb:
options:
# see https://github.com/easybuilders/easybuild-easyconfigs/pull/25222
from-commit: 7dbe8beab98ec0b2daa432aa43ae3a0ed874e859
- acpype-2023.10.27-foss-2023a.eb: