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gmx do_dssp scount.xvg labels a probability as percent when it is not - Redmine #2120

Archive from user: Chris Neale

The -sc scount.xvg output from gmx do_dssp in gmx version 5.1.2 has a final line listing

# SS %   ...

when in fact the numbers sum to 1 and not 100. Since this has existed for a long time (see for example the pasted text from scount.xvg in https://redmine.gromacs.org/issues/683 ) it probably makes sense to stick with the probabilities byt change the comment from “# SS %” to “# SS prob.”

(from redmine: issue id 2120, created on 2017-02-09 by gmxdefault, closed on 2017-03-09)

  • Changesets:
    • Revision 12e29c82 by Mark Abraham on 2017-02-10T13:21:59Z:
Corrected output of gmx do_dssp -sc

This code has always written a probability, and not a percentage, so
fixed the label. It still fits within the expected 8-character field.

Fixes #2120

Change-Id: Ic3256a3942b2f2375e9f4c0771bbe3afe682acf4