# General PRISM configuration for 42-38 system

fundamental:
  ref: "42"
  mut: "38"
  rec: receptor.pdb

model:
  distance: 8
  temperature: 302.15
  concentration: 0.05
  disoff: 1

simulation:
  numofsteps: 500000
  repeats: 4

forcefield:
  # Ligand force field type
  type: gaff2
  # Force field specific parameters
  params: {}  # GAFF2 uses AM1-BCC charges

other:
  verbose: true