On 26/03/2025 07:17, Auffinger Pascal wrote:
Hi Paul,
We are now at point where everything works as we want when we
use the "difference_map_peaks" command.
OK! Progress.
This command opens a GUI and prints a list of peas to the terminal.
We are unable to get this list back into the python script
or to save it as a file.
Difference map peaks was one of the very first tools I programmed and
didn't fully think through the function naming.
Try map_peaks_around_molecule_py()
Paul.
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