VP dt=2.0fs with SHAKE, NPT aMD boost pot and dih
&cntrl
	imin=0, irest=1,infe=1, ntx=5, dt=0.002, ntc=2, ntf=2,
	tol=0.000001, iwrap=1,ntb=2, cut=10.0, ntp=1, pres0=10000, igb=0,
	ioutfm = 1,ntt=3, temp0=300.00, gamma_ln=1.0,
	ig=-1, ntpr=1000, ntwx=100000, ntwr=2000000, nstlim=250000000,
	iamd=3, EthreshD=1282, alphaD=60.8, EthreshP=-30571 , alphaP=2027,
/

&abmd
   mode = 'ANALYSIS'

   monitor_file = 'monitor.txt'
   monitor_freq = 1
   cv_file = 'cv2.in'

   umbrella_file = 'umbrella.nc'

   timescale = 100.0

   selection_freq = 10000
   selection_constant = 0.001

   wt_temperature =  10000.0
   wt_umbrella_file = 'wt_umbrella.nc'
/

