# Thermodynamic integration with dynamic windows
#   starting from equilibrated system
#   in vacuum, distance-dependent dielectric
#   all solute-solute interactions, no pairlist calc
 &cntrl
   irest=0, ntx=5, init=4,
   nstlim=-1, dt=0.0005,
   nscm=201000,
   ntt=-201000, dtemp=100,
   ntc=1, ntf=1,
   tol=0.000005,
   ntb=0, temp0=300.0, 
   idiel=0, scee=2.0,
   iftres=0, nsnb=999999,
   idifrg=1, isldyn=-2,
   nstmeq=1000, nstmul=200000,
   ntpr=1000,
 &end