Help on job https://mobyle.rpbs.univ-paris-diderot.fr/data/jobs/attract/D10504987685919

I am trying to launch the docking job but I am getting an error message:
“No such file or directory”

I have been on the attract website and followed the link to run the job on this site. What am I doing wrong?

Session information:

  • id: 78cf05036bec55c31c9a00b02d708c04
  • email: jkxmaier@freenet.de
  • activated?: True
  • authenticated?: True

Job information:

Hello,
I am sorry, our ATTRACT service is a bit bare-bones and doesn’t report error messages well. The actual error message is: “ValidationError: The GRADSCOPT step potential is not compatible with harmonic modes”. This is strange, since this error message should have been caught already by the TUM web interface.
Hope that helps
Sjoerd

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