NameError: name 'warnings' is not defined

[aprijal99]

Bug Behavior

I got the following error when executing openmmdl_setup:

Traceback (most recent call last):
  File "/home/aprijal/miniconda3/envs/openmm/bin/openmmdl_setup", line 5, in <module>
    from openmmdl.openmmdl_setup.openmmdlsetup import main
  File "/home/aprijal/miniconda3/envs/openmm/lib/python3.12/site-packages/openmmdl/openmmdl_setup/openmmdlsetup.py", line 34, in <module>
    warnings.filterwarnings("ignore")
    ^^^^^^^^
NameError: name 'warnings' is not defined. Did you mean: 'Warning'? Or did you forget to import 'warnings'?

Additional Information

• OpenMMDL v1.1.1 Release (installation from conda)
• Python version 3.10 and 3.12
• Operating system Ubuntu 25.04

[Desperadus]

Hi, I also had this issue, but simply adding the import to the openmmdlsetup.py file has resolved it. I see that the import is already present in the current commit, so I expect this issue to be fixed in the next release.

[talagayev]

Hey @aprijal99 and @Desperadus,

Thanks for mentioning this Issue. @NDoering99 fixed it with the latest PR #173.

Thanks again and sorry for the late reply, we were occupied in the last couple of fix, so didn't have time to adress that Issue.

The next release of OpenMMDL should be done this week/weekend, we need to add a couple of final PRs and do the final checks and then it will be also working fine in the newest release :)