Tools to create packing lists and packages for the SEAMM environment.
- Free software: BSD license
- Documentation: https://molssi-seamm.github.io
- Code: https://github.com/molssi-seamm/packaging
- TODO
There is a Docker image available for SEAMM. It is available at the Github Container Registry (ghcr.io) as
ghcr.io/molssi-seamm/seamm:<version>
Where <version> is the explicit version tag for the desired image. The tag latest is quite confusing, and does not mean the latest version of the image, so we recomend using explcit versions rather than latest.
The container is run with the following command:
docker run --rm -v $PWD:/home ghcr.io/molssi-seamm/seamm:<version> ?flowchart?
where flowchart is an optional flowchart to load into SEAMM.
Developed by the Molecular Sciences Software Institute (MolSSI), which receives funding from the National Science Foundation under awards OAC-1547580 and CHE-2136142.