Closed wbinventor closed 7 years ago
So, I have addressed this in branch https://github.com/cjosey/opendeplete/commit/5dade3326ae7945fd019ece59e7269bee396d0d9
This adds OPENDEPLETE_CHAIN
to environment variables. It can be overridden by setting it the same way it has been done before (useful for the test suite).
I also added a few helpful messages for when files don't exist, aren't the files we expected, or not files at all (say, a random python object). I will be PRing it tomorrow.
Closed per @cjosey's #16.
This is the first in a series of issues I plan to create as I attempt to apply OpenDeplete to deplete a few benchmark problems of mine. I would suggest that we may introduce an environment variable like
OPENDEPLETE_CHAINS
which points to the path of chains of interest, rather than requiring that it be hard-coded into theSettings
wrapper as is shown in the example file here:https://github.com/mit-crpg/opendeplete/blob/master/scripts/example_run.py#L21