#### PROGRAM PARAMETERS #### backend = CPU backend_precision = double seed = 18118 #### SIM PARAMETERS #### sim_type = VMMC ensemble = NVT steps = 1e8 delta_translation = 0.11 delta_rotation = 0.22 T = 20C verlet_skin = 1.00 umbrella_sampling = 1 op_file = /rds/general/user/ag4916/home/DISPL_SS/NEW/DS_25/DS_25_2/18112_6/op.txt weights_file = /rds/general/user/ag4916/home/DISPL_SS/NEW/DS_25/DS_25_2/18112_6/wfile.txt ### Seq. Dependence ########## use_average_seq = 1 small_system = 1 #### INPUT / OUTPUT #### topology = /rds/general/user/ag4916/home/DISPL_SS/NEW/DS_25/DS_25_2/18112_6/generated.top conf_file = /rds/general/user/ag4916/home/DISPL_SS/NEW/DS_25/DS_25_2/18112_6/traj_ds_25_duplex.dat trajectory_file = trajectory.dat no_stdout_energy = 0 restart_step_counter = 1 energy_file = energy.dat print_conf_interval = 1e4 print_energy_every = 1e4 time_scale = linear external_forces = 1 external_forces_file = /rds/general/user/ag4916/home/DISPL_SS/DS_25/forces.dat fix_diffusion = 0