Summary
Lean installable package for structural biologists: pip install cryoem-halfmap-qc → halfmap-qc CLI.
- Reliability path: windowed smoothness on z-scored half-map average ρ →
reliability_score(ranked) andbuild_zoneMRCs - Package boundary: thesis-only code (ROC/AUC, metric comparison, cohort figures, TV curvature) moved to
thesis/— not shipped on PyPI - Naming: production metric is
reliability_smoothness/windowed_smoothness(legacyreliability_H_reproCSV columns still read) - Style:
style/palette.py+style/figures.pyreplacenature.py/thesis_palette.py
Install
pip install cryoem-halfmap-qc
halfmap-qc # interactive: two half-maps → reliability + build-zone MRCsBreaking changes
- Removed public exports for T/L/H mechanics,
placement_utility,tv_curvature, and related thesis modules fromcryoem_mrc - Q-score validation in the package no longer depends on
metric_comparison/residue_metrics.csv(uses halfmap reliability bundle instead)