From ecdfddbe356ebe1fed638a137260d03297e1de8d Mon Sep 17 00:00:00 2001 From: Christoph Junghans Date: Wed, 14 Feb 2024 23:28:42 -0500 Subject: [PATCH 1/2] fedora: add v2019.6 container --- .github/workflows/continuous-integration-workflow.yml | 2 ++ 1 file changed, 2 insertions(+) diff --git a/.github/workflows/continuous-integration-workflow.yml b/.github/workflows/continuous-integration-workflow.yml index 1ec4a18..b545c87 100644 --- a/.github/workflows/continuous-integration-workflow.yml +++ b/.github/workflows/continuous-integration-workflow.yml @@ -28,6 +28,8 @@ jobs: - {dockerfile: 'opensuse', tag: 'latest', continue-on-error: 'true'} - {dockerfile: 'fedora', tag: 'latest', build_args: 'GMX_BRANCH=release-2019,GMX_DOUBLE=ON'} - {dockerfile: 'fedora', tag: 'gmx2019', build_args: 'GMX_BRANCH=release-2019'} + - {dockerfile: 'fedora', tag: 'gmx2019.6_d', build_args: 'GMX_BRANCH=v2019.6,GMX_DOUBLE=ON'} + - {dockerfile: 'fedora', tag: 'gmx2019.6', build_args: 'GMX_BRANCH=v2019.6'} - {dockerfile: 'fedora', tag: 'gmx2024_d', build_args: 'GMX_BRANCH=release-2024,GMX_DOUBLE=ON'} - {dockerfile: 'fedora', tag: 'gmx2024', build_args: 'GMX_BRANCH=release-2024'} - {dockerfile: 'fedora', tag: 'gmx9999_d', build_args: 'GMX_BRANCH=main,GMX_DOUBLE=ON', continue-on-error: 'true'} From cbabfadf52f3f655bcb32b716c1f974453b2b358 Mon Sep 17 00:00:00 2001 From: Christoph Junghans Date: Thu, 15 Feb 2024 08:37:32 -0500 Subject: [PATCH 2/2] fedora: patch gmx 2019.6 as well --- fedora | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/fedora b/fedora index c61e22f..96522e2 100644 --- a/fedora +++ b/fedora @@ -51,7 +51,7 @@ ENV OMPI_MCA_mtl=^ofi # build certain gromacs version as user RUN if [ -n "${GMX_BRANCH}" ] && [ "${GMX_BRANCH}" != "none" ]; then \ git clone --depth 1 -b "${GMX_BRANCH}" https://gitlab.com/gromacs/gromacs.git && \ - if [ "${GMX_BRANCH}" != release-2019 ]; then \ + if [[ "${GMX_BRANCH}" != *2019* ]]; then \ gmx_cmake_opts="-DGMX_INSTALL_LEGACY_API=ON"; \ else \ curl https://gitlab.com/gromacs/gromacs/-/merge_requests/1524.patch | patch -d gromacs -p 1; \