Bug Description
Running Arkane.py takes much longer than expected (i.e. close to 1 hour rather than 1 second on a local machine) for simple TST calculations.
How To Reproduce
Go to RMG-Py/examples/arkane/reactions/ and run Arkane.py on any of the input.py files in any of the examples.
You will see that Arkane starts executing, but slows down as it starts processing the Julia imports.
Expected Behavior
Arkane should finish running in just a few seconds.
Installation Information
- Ubuntu 20.04.6 LTS
- install from source with Anaconda, RMG-Py tag
3.2.0-115-g87b96e1b0, RMG-database tag 3.2.0
Additional Context
The slowdown is from Arkane importing RMG's CoreEdgeReactionModel , which imports RMG reactors, which then import the Julia modules (loading the Julia stuff is really slow.)
Since I'm only using Arkane for conventional TST, I was able to get the runtime back to the expected ~1 seconds by commenting out all of the instances where CoreEdgeReactionModel or ExplorerJob are imported when Arkane.py is called.
Bug Description
Running
Arkane.pytakes much longer than expected (i.e. close to 1 hour rather than 1 second on a local machine) for simple TST calculations.How To Reproduce
Go to
RMG-Py/examples/arkane/reactions/and runArkane.pyon any of theinput.pyfiles in any of the examples.You will see that Arkane starts executing, but slows down as it starts processing the Julia imports.
Expected Behavior
Arkane should finish running in just a few seconds.
Installation Information
3.2.0-115-g87b96e1b0, RMG-database tag3.2.0Additional Context
The slowdown is from Arkane importing RMG's
CoreEdgeReactionModel, which imports RMG reactors, which then import the Julia modules (loading the Julia stuff is really slow.)Since I'm only using Arkane for conventional TST, I was able to get the runtime back to the expected ~1 seconds by commenting out all of the instances where
CoreEdgeReactionModelorExplorerJobare imported when Arkane.py is called.