Thank you for the suggestion, I'll see what I can do

On Tue, Nov 28, 2023 at 2:02 PM gennaro.pescitelli--- via ChimeraX-users <chimerax-users@cgl.ucsf.edu> wrote:
Hi Tony,

thank you for you reply. This would be a very useful option in the context of ECD and CPL calculations. I look forward to it.

Another option I may suggest is the possibility to add manual populations or relative energies when averaging a UV or ECD spectrum.
The option to select a different file is nice indeed, but sometimes one has populations from a different software or even from experiment
(e.g. NMR) or may want to try the effect of different populations on the average spectra.

Thanks a lot

Rino
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