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Opened 5 years ago
#4207 assigned enhancement
Make gaussian cube file reader create atoms
| Reported by: | Owned by: | Tom Goddard | |
|---|---|---|---|
| Priority: | moderate | Milestone: | |
| Component: | Volume Data | Version: | |
| Keywords: | Cc: | ||
| Blocked By: | Blocking: | ||
| Notify when closed: | Platform: | all | |
| Project: | ChimeraX |
Description
I made example Python code to create the atoms
https://rbvi.github.io/chimerax-recipes/gaussian_cube_atoms/gcatoms.html
but it will take some thinking to figure out how to put that into the distribution since the current volume reader code can only return a GridData object.
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