Guide to Kartograf

Applications:

• Application for Reindexing Problem
• Application in Free Energy Calculations
  • References

Algorithms:

• Atom Mapping
  • Atom Mapping Filters
• Atom Mapping Scoring
• Molecule Alignment Algorithms
  • Skeleton-Based Alignment (MCS)
  • Shape-Based Alignment (Open3DAlign)
  • Choosing Between the Two Methods