diff --git a/examples/USER/cg-cmm/peg-verlet/parm.pegc12e8 b/examples/USER/cg-cmm/peg-verlet/parm.pegc12e8 deleted file mode 100644 index d85d030edd..0000000000 --- a/examples/USER/cg-cmm/peg-verlet/parm.pegc12e8 +++ /dev/null @@ -1,42 +0,0 @@ -# Solvated 5-mer peptide CG force field - -pair_style lj/sdk 15.0 -bond_style harmonic -angle_style harmonic -special_bonds lj/coul 0.0 0.0 1.0 - -mass 1 31.035 -mass 2 44.054 -mass 3 42.081 -mass 4 29.062 -mass 5 54.000 - -pair_coeff 1 1 lj9_6 0.4491 3.7130 -pair_coeff 1 2 lj9_6 0.4400 3.8900 -pair_coeff 1 3 lj9_6 0.3650 3.9870 -pair_coeff 1 4 lj9_6 0.3800 3.8400 -pair_coeff 1 5 lj12_4 0.7000 3.9500 -pair_coeff 2 2 lj9_6 0.4050 4.2500 -pair_coeff 2 3 lj9_6 0.3770 4.2740 -pair_coeff 2 4 lj9_6 0.3700 4.1400 -pair_coeff 2 5 lj12_4 0.5700 4.3100 -pair_coeff 3 3 lj9_6 0.4200 4.5060 -pair_coeff 3 4 lj9_6 0.3620 4.3635 -pair_coeff 3 5 lj12_4 0.3400 4.4385 -pair_coeff 4 4 lj9_6 0.3120 4.2210 -pair_coeff 4 5 lj12_4 0.2900 4.2960 -pair_coeff 5 5 lj12_4 0.8950 4.3710 - -bond_coeff 1 15.00 2.79 -bond_coeff 2 4.900 3.28 -bond_coeff 3 7.100 3.56 -bond_coeff 4 6.160 3.64 -bond_coeff 5 9.000 3.13 - -angle_coeff 1 3.000 131.0 -angle_coeff 2 3.400 132.0 -angle_coeff 3 3.200 146.0 -angle_coeff 4 1.500 172.0 -angle_coeff 5 1.190 173.0 -angle_coeff 6 1.600 172.0 - diff --git a/examples/USER/cg-cmm/peg-verlet/parm.pegc12e8-angle b/examples/USER/cg-cmm/peg-verlet/parm.pegc12e8-angle deleted file mode 100644 index 98dbcb956a..0000000000 --- a/examples/USER/cg-cmm/peg-verlet/parm.pegc12e8-angle +++ /dev/null @@ -1,42 +0,0 @@ -# Solvated 5-mer peptide CG force field - -pair_style cg/cmm 15.0 -bond_style harmonic -angle_style cg/cmm -special_bonds 0.0 0.0 1.0 - -mass 1 31.035 -mass 2 44.054 -mass 3 42.081 -mass 4 29.062 -mass 5 54.000 - -pair_coeff 1 1 lj9_6 0.4491 3.7130 -pair_coeff 1 2 lj9_6 0.4400 3.8900 -pair_coeff 1 3 lj9_6 0.3650 3.9870 -pair_coeff 1 4 lj9_6 0.3800 3.8400 -pair_coeff 1 5 lj12_4 0.7000 3.9500 -pair_coeff 2 2 lj9_6 0.4050 4.2500 -pair_coeff 2 3 lj9_6 0.3770 4.2740 -pair_coeff 2 4 lj9_6 0.3700 4.1400 -pair_coeff 2 5 lj12_4 0.5700 4.3100 -pair_coeff 3 3 lj9_6 0.4200 4.5060 -pair_coeff 3 4 lj9_6 0.3620 4.3635 -pair_coeff 3 5 lj12_4 0.3400 4.4385 -pair_coeff 4 4 lj9_6 0.3120 4.2210 -pair_coeff 4 5 lj12_4 0.2900 4.2960 -pair_coeff 5 5 lj12_4 0.8950 4.3710 - -bond_coeff 1 15.00 2.79 -bond_coeff 2 4.900 3.28 -bond_coeff 3 7.100 3.56 -bond_coeff 4 6.160 3.64 -bond_coeff 5 9.000 3.13 - -angle_coeff 1 3.000 131.0 lj9_6 0.4400 3.8900 -angle_coeff 2 3.400 132.0 lj9_6 0.4050 4.2500 -angle_coeff 3 3.200 146.0 lj9_6 0.3770 4.2740 -angle_coeff 4 1.500 172.0 lj9_6 0.3770 4.2740 -angle_coeff 5 1.190 173.0 lj9_6 0.4200 4.5060 -angle_coeff 6 1.600 172.0 lj9_6 0.3620 4.3635 -