Cavities

This section describes the cavity constructions available in MOIST and the settings that control their shape and surface discretization.

Note

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• DROP cavity
  • Passing settings
  • Level-set functions (LSF)
    • Smooth van der Waals (SvdW)
    • COSMO Fine Cavity (CFC)
  • Grid discretization
  • Numerical tolerance
  • Surface projection
  • Switching functions
  • Weight pruning
  • Branching
  • Spatial screening
  • Disconnected points
• iSwiG cavity
  • Settings