From cbe0112c7e1ed19e498c7b7f8c7c5655745694a4 Mon Sep 17 00:00:00 2001 From: =?UTF-8?q?Bob=20Dr=C3=B6ge?= Date: Thu, 17 Sep 2026 20:43:28 +0200 Subject: [PATCH 1/7] add GROMACS-2026.3-foss-2026.1-CUDA-13.3.0.eb --- .../2026.06/accel/nvidia/eessi-2026.06-eb-5.4.0-2026.1.yml | 5 +++++ 1 file changed, 5 insertions(+) create mode 100644 easystacks/software.eessi.io/2026.06/accel/nvidia/eessi-2026.06-eb-5.4.0-2026.1.yml diff --git a/easystacks/software.eessi.io/2026.06/accel/nvidia/eessi-2026.06-eb-5.4.0-2026.1.yml b/easystacks/software.eessi.io/2026.06/accel/nvidia/eessi-2026.06-eb-5.4.0-2026.1.yml new file mode 100644 index 0000000000..fb8fdb44e8 --- /dev/null +++ b/easystacks/software.eessi.io/2026.06/accel/nvidia/eessi-2026.06-eb-5.4.0-2026.1.yml @@ -0,0 +1,5 @@ +easyconfigs: + - GROMACS-2026.3-foss-2026.1-CUDA-13.3.0.eb: + options: + # see https://github.com/easybuilders/easybuild-easyconfigs/pull/26762 + from-commit: be373ac681e8bf5bccafd7036978220edc8e8fc1 From 728b482556af2cdd82e72faea1c315efe4fc44af Mon Sep 17 00:00:00 2001 From: =?UTF-8?q?Bob=20Dr=C3=B6ge?= Date: Mon, 21 Sep 2026 15:01:23 +0200 Subject: [PATCH 2/7] use modified easyblock --- .../2026.06/accel/nvidia/eessi-2026.06-eb-5.4.0-2026.1.yml | 2 ++ 1 file changed, 2 insertions(+) diff --git a/easystacks/software.eessi.io/2026.06/accel/nvidia/eessi-2026.06-eb-5.4.0-2026.1.yml b/easystacks/software.eessi.io/2026.06/accel/nvidia/eessi-2026.06-eb-5.4.0-2026.1.yml index fb8fdb44e8..f042c01a7f 100644 --- a/easystacks/software.eessi.io/2026.06/accel/nvidia/eessi-2026.06-eb-5.4.0-2026.1.yml +++ b/easystacks/software.eessi.io/2026.06/accel/nvidia/eessi-2026.06-eb-5.4.0-2026.1.yml @@ -3,3 +3,5 @@ easyconfigs: options: # see https://github.com/easybuilders/easybuild-easyconfigs/pull/26762 from-commit: be373ac681e8bf5bccafd7036978220edc8e8fc1 + # see https://github.com/easybuilders/easybuild-easyblocks/pull/4234 + include-easyblocks-from-commit: 989c4488fbc857ea55e20392d53f0327272f0756 From c04a1a16a69b049aee0332bfa62a4ed46c877aa5 Mon Sep 17 00:00:00 2001 From: =?UTF-8?q?Bob=20Dr=C3=B6ge?= Date: Mon, 21 Sep 2026 19:25:22 +0200 Subject: [PATCH 3/7] bump GROMACS commit --- .../2026.06/accel/nvidia/eessi-2026.06-eb-5.4.0-2026.1.yml | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/easystacks/software.eessi.io/2026.06/accel/nvidia/eessi-2026.06-eb-5.4.0-2026.1.yml b/easystacks/software.eessi.io/2026.06/accel/nvidia/eessi-2026.06-eb-5.4.0-2026.1.yml index f042c01a7f..a1c4d4ae5e 100644 --- a/easystacks/software.eessi.io/2026.06/accel/nvidia/eessi-2026.06-eb-5.4.0-2026.1.yml +++ b/easystacks/software.eessi.io/2026.06/accel/nvidia/eessi-2026.06-eb-5.4.0-2026.1.yml @@ -2,6 +2,6 @@ easyconfigs: - GROMACS-2026.3-foss-2026.1-CUDA-13.3.0.eb: options: # see https://github.com/easybuilders/easybuild-easyconfigs/pull/26762 - from-commit: be373ac681e8bf5bccafd7036978220edc8e8fc1 + from-commit: b1eada261e1144d75a604c945b8b1dee0dd63584 # see https://github.com/easybuilders/easybuild-easyblocks/pull/4234 include-easyblocks-from-commit: 989c4488fbc857ea55e20392d53f0327272f0756 From 88d2f2b56d2af432719779cc65a75806ecdc32e4 Mon Sep 17 00:00:00 2001 From: =?UTF-8?q?Bob=20Dr=C3=B6ge?= Date: Mon, 12 Oct 2026 11:50:10 +0200 Subject: [PATCH 4/7] bump easyblock commit --- .../2026.06/accel/nvidia/eessi-2026.06-eb-5.4.0-2026.1.yml | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/easystacks/software.eessi.io/2026.06/accel/nvidia/eessi-2026.06-eb-5.4.0-2026.1.yml b/easystacks/software.eessi.io/2026.06/accel/nvidia/eessi-2026.06-eb-5.4.0-2026.1.yml index a1c4d4ae5e..8173aa2abe 100644 --- a/easystacks/software.eessi.io/2026.06/accel/nvidia/eessi-2026.06-eb-5.4.0-2026.1.yml +++ b/easystacks/software.eessi.io/2026.06/accel/nvidia/eessi-2026.06-eb-5.4.0-2026.1.yml @@ -4,4 +4,4 @@ easyconfigs: # see https://github.com/easybuilders/easybuild-easyconfigs/pull/26762 from-commit: b1eada261e1144d75a604c945b8b1dee0dd63584 # see https://github.com/easybuilders/easybuild-easyblocks/pull/4234 - include-easyblocks-from-commit: 989c4488fbc857ea55e20392d53f0327272f0756 + include-easyblocks-from-commit: cdca82abd5ea1beff7a501124de736d660c5f6c6 From 0eca40c7284d3629294d8160822a25ee39d38aa8 Mon Sep 17 00:00:00 2001 From: =?UTF-8?q?Bob=20Dr=C3=B6ge?= Date: Mon, 12 Oct 2026 13:13:06 +0200 Subject: [PATCH 5/7] bump easyblock commit --- .../2026.06/accel/nvidia/eessi-2026.06-eb-5.4.0-2026.1.yml | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/easystacks/software.eessi.io/2026.06/accel/nvidia/eessi-2026.06-eb-5.4.0-2026.1.yml b/easystacks/software.eessi.io/2026.06/accel/nvidia/eessi-2026.06-eb-5.4.0-2026.1.yml index 8173aa2abe..802862c790 100644 --- a/easystacks/software.eessi.io/2026.06/accel/nvidia/eessi-2026.06-eb-5.4.0-2026.1.yml +++ b/easystacks/software.eessi.io/2026.06/accel/nvidia/eessi-2026.06-eb-5.4.0-2026.1.yml @@ -4,4 +4,4 @@ easyconfigs: # see https://github.com/easybuilders/easybuild-easyconfigs/pull/26762 from-commit: b1eada261e1144d75a604c945b8b1dee0dd63584 # see https://github.com/easybuilders/easybuild-easyblocks/pull/4234 - include-easyblocks-from-commit: cdca82abd5ea1beff7a501124de736d660c5f6c6 + include-easyblocks-from-commit: 3932722e700d81e394965cf0b19b873448f1399d From 9b21bc7a34154dd752bef5237cb52a1c6528d9af Mon Sep 17 00:00:00 2001 From: =?UTF-8?q?Bob=20Dr=C3=B6ge?= Date: Mon, 12 Oct 2026 13:43:55 +0200 Subject: [PATCH 6/7] bump easyblock commit --- .../2026.06/accel/nvidia/eessi-2026.06-eb-5.4.0-2026.1.yml | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/easystacks/software.eessi.io/2026.06/accel/nvidia/eessi-2026.06-eb-5.4.0-2026.1.yml b/easystacks/software.eessi.io/2026.06/accel/nvidia/eessi-2026.06-eb-5.4.0-2026.1.yml index 802862c790..3a0258cb73 100644 --- a/easystacks/software.eessi.io/2026.06/accel/nvidia/eessi-2026.06-eb-5.4.0-2026.1.yml +++ b/easystacks/software.eessi.io/2026.06/accel/nvidia/eessi-2026.06-eb-5.4.0-2026.1.yml @@ -4,4 +4,4 @@ easyconfigs: # see https://github.com/easybuilders/easybuild-easyconfigs/pull/26762 from-commit: b1eada261e1144d75a604c945b8b1dee0dd63584 # see https://github.com/easybuilders/easybuild-easyblocks/pull/4234 - include-easyblocks-from-commit: 3932722e700d81e394965cf0b19b873448f1399d + include-easyblocks-from-commit: f6f23d4674dbc684aff706abc5f436363ba3edcf From 1b4706f51848bb466436dd8cfeae891f409cd76e Mon Sep 17 00:00:00 2001 From: =?UTF-8?q?Bob=20Dr=C3=B6ge?= Date: Mon, 12 Oct 2026 14:00:18 +0200 Subject: [PATCH 7/7] also bump easyconfigs commit --- .../2026.06/accel/nvidia/eessi-2026.06-eb-5.4.0-2026.1.yml | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/easystacks/software.eessi.io/2026.06/accel/nvidia/eessi-2026.06-eb-5.4.0-2026.1.yml b/easystacks/software.eessi.io/2026.06/accel/nvidia/eessi-2026.06-eb-5.4.0-2026.1.yml index 3a0258cb73..e87ca47fb3 100644 --- a/easystacks/software.eessi.io/2026.06/accel/nvidia/eessi-2026.06-eb-5.4.0-2026.1.yml +++ b/easystacks/software.eessi.io/2026.06/accel/nvidia/eessi-2026.06-eb-5.4.0-2026.1.yml @@ -2,6 +2,6 @@ easyconfigs: - GROMACS-2026.3-foss-2026.1-CUDA-13.3.0.eb: options: # see https://github.com/easybuilders/easybuild-easyconfigs/pull/26762 - from-commit: b1eada261e1144d75a604c945b8b1dee0dd63584 + from-commit: 4ee416d82564a3aa8dd3952cb0039d1c8081a22f # see https://github.com/easybuilders/easybuild-easyblocks/pull/4234 include-easyblocks-from-commit: f6f23d4674dbc684aff706abc5f436363ba3edcf