Paper VIII of Statistical Pharmacology via Kakutani Dichotomy: validation on real PDB ensembles (ubiquitin NMR, adenylate kinase), Isserlis bound and influence-function block selection, bootstrap coverage calibration. Code, data, paper.
reproducible-research protein-data-bank adenylate-kinase influence-functions ledoit-wolf block-bootstrap elastic-network-models ubiquitin kakutani-dichotomy conformational-ensembles statistical-pharmacology nmr-ensembles isserlis-theorem coverage-calibration
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Sep 29, 2026 - Python