50ps NEB ALA-ALA cool stage 2 &cntrl imin = 0, irest = 1, ntx=5, ntc=1, ntf=1, ntpr=100, ntwx=10000, ntb = 0, cut = 999.0, rgbmax=999.0, igb = 1, saltcon=0.2, nstlim = 200000, nscm= 0, dt = 0.001, ntt = 3, gamma_ln=1000.0, temp0=0.0, ineb = 1,skmin = 50,skmax = 50, vv=1,vfac=0.1 /