Clicking into the convergence table throws Pyton error

[benedekstdlr]

For ORCA optimisation jobs (not tested with any other program), when any of the rows in the convergence table are clicked, the following error is thrown:

IndexError: No coordset id 132

File "C:\Program Files\ChimeraX 1.10.1\bin\Lib\site-packages\chimerax\atomic\molc.py", line 130, in set_prop
cset(self._c_pointer_ref, 1, v_ref)

See log for complete Python traceback.
Where the coordset id corresponds to the row clicked.

[ajs99778]

Thanks for reporting this. I'm not able to reproduce it with any of the orca files I've tried. If possible, could you send one that causes this error? If not, it would be helpful to have the input settings.

[benedekstdlr]

Hi Tony,
I am not able to reproduce this either with the recent SEQCROW update. I think it may have had something to do with outputs from compound optimisation jobs, but this seems to be problem-free now too. You can close the ticket, I will open a new ticket if I find an output that still gives the error with the new version.
Thanks, Benedek