JudeWells / chainsaw

MIT License
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Post proc #2

Closed JudeWells closed 1 year ago

JudeWells commented 1 year ago

Add post-processing to: Remove domains with less than 2 secondary structure elements Remove domains with fewer than minimum number of residues Remove domains where proportion of residues in secondary structure are less than some proportion

Also: Moved the pymol visualisation call inside the iteration loop so that it's possible to inspect output images before the whole job has been completed. (Need to fix this so it still works when the input method is NOT a whole directory)

Was getting errors with the create_pymol() function when I passed the results object so tried to change that but not sure if changes are using it as intended.

It looked like I was not getting csv results output - but possibly this is because I didn't run the job to completion.