Releases: molssi-seamm/packmol_step
Releases · molssi-seamm/packmol_step
Internal: moving to GitHub Actions for CI/CD
No change in functionality, but making sure that everything works using GitHub Action for continuous integration (CI) and deployment (CD)
Moving to new command-line argument handling
Merge pull request #16 from molssi-seamm/option-handling Updated for the new command-line argument handling
Adding citations.
Merge pull request #15 from molssi-seamm/citations Adding citations using new framework for them
Updated to work with the new system definition.
Merge pull request #12 from molssi-seamm/system Moved to the new system.
Fixed bugs with edit dialog.
Merge pull request #11 from molssi-seamm/openkim Added check in forcefield section for OpenKIM
Added plotting capabilities.
Consolidating a number of changes, but the noticeable user visible change is the addition of Plotly plots, which are currently used in LAMMPS.
End of 2019
This release contains the fixes for the "Cancel" button problem, wherein clicking Cancel did not update the GUI.
Running version with reasonable output
Merge pull request #5 from molssi-seamm/cleanup/description Cleanup/description