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haewonc / analyze_dfg_ranges.py
Created February 5, 2026 17:52
DFG Motif Range Analysis Script - Analyze RMSD variations for different residue ranges around the DFG motif in kinases_noligand benchmark
#!/usr/bin/env python3
"""
DFG Motif Range Analysis Script
Analyze RMSD variations for different residue ranges around the DFG motif in kinases_noligand benchmark.
Tests ranges from [1]DFG[9] to [9]DFG[1] with total window size of 13 residues.
Uses existing metric_resid_ranges as reference and query sequences for DFG identification.
"""
import csv