Zap TK

• Front Matter

Zap Theory and Examples

• The What of Zap
• The Why of Zap
• The Way of Zap
  • Partial Charges and Atomic Radii
  • Grids
  • Atom Potentials
  • Solvation Energies: PBSA
  • Binding Energies
  • Focussing
  • Gradients/Forces
  • Electrostatic Similarity

API

• OEPB Classes
  • OEArea
  • OEBind
  • OEBindResults
  • OEET
  • OESimpleBindResults
  • OEZap
• OEPB Constants
  • OEAreaMethod
  • OEZapDielectricModel
• OEPB Functions
  • OECalculateCoulombicBinding
  • OECoulombicAtomPotentials
  • OECoulombicSelfEnergy
  • OEMakeETGrid
  • OEZapBind
  • OEZapGetArch
  • OEZapGetLicensee
  • OEZapGetPlatform
  • OEZapGetRelease
  • OEZapGetSite
  • OEZapGetVersion
  • OEZapIsLicensed

Release Notes

• ZapTK 2.1.2
• ZapTK 2.1.1
• ZapTK 2.1.0
• ZapTK 2.0.0

Indices and tables

• Index
• Search Page