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Arpeggio output handling #18

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stuartmac opened this issue Nov 21, 2017 · 0 comments
Open

Arpeggio output handling #18

stuartmac opened this issue Nov 21, 2017 · 0 comments
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@stuartmac
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table_generator is has been yielding FileNotFound errors from the ARPEGGIOrunner (e.g., FileNotFoundError: [Errno 2] No such file or directory: './pdbx/1exa_new.amam'). Weirdly it will work the second time it is run if override=False.

I think this comes down to the fact that Arpeggio often does not produce many of its possible outputs for all structures, when "special" contacts are not found.

When I was first getting prointvar to work with my data I may have come upon this same but that I thought I'd fixed by setting parse_special=False but whilst this is part of a temporary fix, I wasn't cleaning the output between runs so I only came upon this when I wanted to rerun the analysis with bio units.

Complicated!

@stuartmac stuartmac added the bug label Nov 21, 2017
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