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ersilia-os / zaira-chem

Automated QSAR based on multiple small molecule descriptors
GNU General Public License v3.0
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Error messages when running zairachem without GPU (usability issue) #13

Open marcostorrework opened 1 year ago

marcostorrework commented 1 year ago

Describe the bug When using a computer without a GPU, every time that the zairachem CLI command is run, several lines of (harmless) errors are displayed. See screenshot. This is just a usability issue, as it does not prevent the tool from working.

To Reproduce Steps to reproduce the behavior: In a computer without GPU, run the zairachem CLI command, with any options. The errors appear at the beginning.

Expected behavior It would be a better user experience to remove these error messages and instead show a warning, something like "Warning: no GPU available - Zairachem can still be used but some of the models will require longer training time."

Screenshots

Screenshot errors no GPU

Desktop (please complete the following information):

miquelduranfrigola commented 1 year ago

As we are preparing the ZairaChem release, all of this will be solved. Well noted, thanks.