firststep 0
numsteps 2000

# seed 1234

posfile examples/argon_400/argon.pdb
velfile examples/argon_400/argon.vel.pdb
psffile examples/argon_400/argon.psf
parfile examples/argon_400/argon.par
# temperature 300.0 

usecharmm28parfile yes

#outputfreq 1
#allenergiesfile argon.out.energies.lf

boundaryConditions Periodic

cellManager Cubic
cellsize 6.5

#Integrator {

#  level 0 Leapfrog {

#        timestep 1

    # force Improper,
    #       Dihedral,
    #       Bond,
    #       Angle 

#    force LennardJones
#            -algorithm NonbondedSimpleFull
    #       -algorithm NonbondedCutoff
    #       -switchingFunction C2
    #       -switchon 0.1
    #       -cutoff 6.5

    # force Coulomb
    #       -algorithm NonbondedCutoff
    #       -switchingFunction C1
    #       -cutoff 6.5

#  }

#}