We had to cancel these work units. Unfortunately they slipped past our quality checks. We are working on a fix and will hopefully have these important COVID-19 jobs out asap. Sorry for these recent issues. These are relatively new tasks and protocols so it's a learning process for us also. On a positive note, these large sampling runs are producing great results that otherwise were never practically possible to obtain.

These 12v1n_ are obviously having some issues. It's rare considering how many jobs were submitted but definitely an issue. These are cyclic peptide jobs so they have a small memory footprint but I'm guessing by random chance there may be situations where the trajectory keeps going for a while due to filtering criteria, but that's just an initial hunch. I'll have to talk to the researcher who ran these jobs and look specifically at the code and process to see what exactly is causing this. I already sent an email and we will start a discussion about this issue and a possible fix for the near future. I suggest aborting these jobs if they continue to run past your run time setting. Sorry for any inconvenience.