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real time parsing of ORCA optimization

Posted: Sun Mar 03, 2024 7:46 am
by jwk
ORCA 5 updates the output.log file as it carries out a geometry optimization. Therefore, it would be helpful if WebMO would parse those file changes and display them on the Results page (just like it does with Gaussian).

Re: real time parsing of ORCA optimization

Posted: Sun Mar 03, 2024 8:12 pm
by schmidt
Excellent suggestion. I've made a note of this new capability on our bug/todo list so we can take advantage in a future update.