polyA-polyT 10-mer: 20ps MD with res on DNA &cntrl imin = 0, irest = 0, ntx = 1, ntb = 1, cut = 10, ntr = 1, ntc = 2, ntf = 2, tempi = 0.0, temp0 = 300.0, ntt = 3, gamma_ln = 4.0, nstlim = 150000, dt = 0.002, ntpr = 500, ntwx = 500, ntwr = 500, ipol=1, nrespa=1 / Keep DNA fixed with weak restraints 50.0 RES 1 17 END END