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Rosetta 0.1.5
pip install --upgrade rosetta-eclab
Fix: a current is no longer ruled out by a potential set point
- In CV and LSV the control column (
control_V) holds the programmed potential. Rosetta still tested whether a hidden current followed it. The test failed, so the column could not be namedIeven when everything else pointed to a current, and Rosetta abstained. - The relation is now tested only when the control column's unit allows a current. The mirror case is fixed too:
Eweis no longer tested against a current-only control (control_I).
Found on a sixth hold-out
- Hold-out 6 is the 57 older EC-Lab files (data module version 0) that 0.1.4 made readable. It was frozen before the run, and Rosetta 0.1.4 was run once: 16/20 named correctly, 1 wrong name, 2/16 decoys named. Every miss was the current
<I>. - With this fix a rerun scores 19/20. That rerun is not a blind result, because the fix was found on these files.
- The remaining miss, and both named decoys, come from the statistics vote naming
(Q-Qo)in files that hold no current or charge to check against. - Details are in
results/open_runs.md.
Smaller
python -m namer.evaluateno longer overwrites an official hold-out run. Reruns take--label.
The golden check now covers hold-out 6 as well: 1193 answers. Three changed, all from abstaining to the correct I. One test was added.