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feature request for grabThermo.py #23

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joegair opened this issue Feb 1, 2025 · 0 comments
Open

feature request for grabThermo.py #23

joegair opened this issue Feb 1, 2025 · 0 comments

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@joegair
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joegair commented Feb 1, 2025

I love how when a file is opened in ChimeraX, seqcrow prints to the log whether there were any errors and the number of imaginary frequencies. It would make my life quite a bit easier if grabThermo.py also printed out the number and frequency of any imaginary freqs and whether the job finished normally.

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