========== Containers ========== |Gromacs| project infrastructure uses Docker containerization to isolate automated tasks. A number of images are maintained to provide a breadth of testing coverage. Scripts and configuration files for building images are stored in the repository under :file:`admin/containers/` Images are (re)built manually by |Gromacs| project staff and pushed to repositories at https://hub.docker.com/u/gromacs Utilities ========= .. automodule:: utility :members: HPC container maker ------------------- We use the `NVidia HPC Container Maker `__ package for scripted Dockerfile generation. See :file:`admin/containers/scripted_gmx_docker_builds.py`. .. todo:: :issue:`3272` Insert tool documentation. E.g. ``.. automodule:: scripted_gmx_docker_builds``