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This is the initial setup of Docker image building and CI workflow. This does not add any libROM component yet.

Automatic building of docker image

As part of the CI test, docker image mgmol_env is automatically generated based on the file docker/Dockerfile. This task is executed in docker-image CI test, only when .github/workflows/docker_image.yml and docker/Dockerfile have any change. The built docker image is uploaded in the github registry of this current repo:

ghcr.io/llnl/mgmol/mgmol_env:latest

CI test for building

.github/workflows/ci.yml conducts the building test to check if the code is compiled successfully.

TODO If needed, we can add any unit test within this CI workflow for further maintenance.

@dalg24-jenkins
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Can one of the admins verify this patch?

@dreamer2368 dreamer2368 marked this pull request as ready for review November 7, 2023 21:07
@dreamer2368 dreamer2368 changed the title Docker ci github ci workflow and docker image building Nov 7, 2023
@jeanlucf22 jeanlucf22 merged commit 2a65021 into ROMFPMD Nov 7, 2023
@jeanlucf22 jeanlucf22 deleted the docker-ci branch November 7, 2023 21:17
jeanlucf22 added a commit that referenced this pull request Apr 24, 2024
* Update script to analyze forces on constraints

* initial ci workflow files.

* default branch name release.

* create build directory for compilation.

* minor fix

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Co-authored-by: Jean-Luc Fattebert <fattebertj@ornl.gov>
jeanlucf22 added a commit that referenced this pull request Apr 26, 2024
* Update script to analyze forces on constraints

* initial ci workflow files.

* default branch name release.

* create build directory for compilation.

* minor fix

---------

Co-authored-by: Jean-Luc Fattebert <fattebertj@ornl.gov>
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4 participants