processors 1 1 1 units lj atom_style bond special_bonds lj/coul 0 1 1 read_data polymer_10c10m.dat neighbor 0.4 bin neigh_modify every 1 delay 1 comm_modify vel yes bond_style fene bond_coeff * 30.0 1.5 1.0 1.0 dump 1 all custom 60000 *_Monomer_Coordinates id mol type x y z ix iy iz compute b1 all property/local btype batom1 batom2 compute b2 all bond/local dist engpot force dump 2 all local 60000 *_Bond_Analysis index c_b1[*] c_b2[*] timestep 0.01 thermo 1000 thermo_style custom step temp pe etotal epair ebond density press pxx pyy pzz lx ly lz pair_style dpd 1.0 1.0 122347 pair_coeff * * 25 4.5 1.0 velocity all create 1.0 17786140 fix 1 all nve run 50000 pair_coeff * * 50.0 4.5 1.0 velocity all create 1.0 15086120 run 50 pair_coeff * * 100.0 4.5 1.0 velocity all create 1.0 15786120 run 50 pair_coeff * * 150.0 4.5 1.0 velocity all create 1.0 15486120 run 50 pair_coeff * * 200.0 4.5 1.0 velocity all create 1.0 17986120 run 100 pair_coeff * * 250.0 4.5 1.0 velocity all create 1.0 15006120 run 100 pair_coeff * * 500.0 4.5 1.0 velocity all create 1.0 15087720 run 100 pair_coeff * * 1000.0 4.5 1.0 velocity all create 1.0 15086189 run 100 unfix 1 fix 2 all npt temp 1.0 1.0 2.0 iso 0.0 0.0 10.0 pair_style lj/cut 2.5 pair_coeff * * 1.0 1.0 2.5 run 6000000 write_data polymer_10x10.data write_restart my_restart_lj