&MD
    ENSEMBLE NVT
    STEPS 10000
    TIMESTEP 5
    TEMPERATURE 85.0
    &THERMOSTAT
      &NOSE                    #Uses the Nose-Hoover thermostat
        TIMECON 100           #timeconstant of the thermostat chain, how often does thermostat adjust your system 
      &END NOSE
    &END
  &END MD