diff --git a/examples/amoeba/in.water_box.amoeba b/examples/amoeba/in.water_box.amoeba index 63ada708f7..da816783f7 100644 --- a/examples/amoeba/in.water_box.amoeba +++ b/examples/amoeba/in.water_box.amoeba @@ -24,6 +24,8 @@ read_data data.water_box.amoeba fix amtype NULL "Tinker Types" pair_style amoeba pair_coeff * * amoeba_water.prm amoeba_water.key +special_bonds lj/coul 0.5 0.5 0.5 one/five yes + # thermo output compute virial all pressure NULL virial diff --git a/examples/amoeba/in.water_box.hippo b/examples/amoeba/in.water_box.hippo index 6547a135b6..4c11bc66d0 100644 --- a/examples/amoeba/in.water_box.hippo +++ b/examples/amoeba/in.water_box.hippo @@ -24,6 +24,8 @@ read_data data.water_box.hippo fix amtype NULL "Tinker Types" pair_style hippo pair_coeff * * hippo_water.prm hippo_water.key +special_bonds lj/coul 0.5 0.5 0.5 one/five yes + # thermo output compute virial all pressure NULL virial diff --git a/examples/amoeba/in.water_dimer.amoeba b/examples/amoeba/in.water_dimer.amoeba index af22009269..1573f87df8 100644 --- a/examples/amoeba/in.water_dimer.amoeba +++ b/examples/amoeba/in.water_dimer.amoeba @@ -24,6 +24,8 @@ read_data data.water_dimer.amoeba fix amtype NULL "Tinker Types" pair_style amoeba pair_coeff * * amoeba_water.prm amoeba_water.key +special_bonds lj/coul 0.5 0.5 0.5 one/five yes + # thermo output compute virial all pressure NULL virial diff --git a/examples/amoeba/in.water_dimer.hippo b/examples/amoeba/in.water_dimer.hippo index b19cbc0f26..c94900c929 100644 --- a/examples/amoeba/in.water_dimer.hippo +++ b/examples/amoeba/in.water_dimer.hippo @@ -24,6 +24,8 @@ read_data data.water_dimer.hippo fix amtype NULL "Tinker Types" pair_style hippo pair_coeff * * hippo_water.prm hippo_water.key +special_bonds lj/coul 0.5 0.5 0.5 one/five yes + # thermo output compute virial all pressure NULL virial diff --git a/examples/amoeba/in.water_hexamer.amoeba b/examples/amoeba/in.water_hexamer.amoeba index cafab56053..b50d0f25df 100644 --- a/examples/amoeba/in.water_hexamer.amoeba +++ b/examples/amoeba/in.water_hexamer.amoeba @@ -24,6 +24,8 @@ read_data data.water_hexamer.amoeba fix amtype NULL "Tinker Types" pair_style amoeba pair_coeff * * amoeba_water.prm amoeba_water.key +special_bonds lj/coul 0.5 0.5 0.5 one/five yes + # thermo output compute virial all pressure NULL virial diff --git a/examples/amoeba/in.water_hexamer.hippo b/examples/amoeba/in.water_hexamer.hippo index 27cdb6e634..c3ece34c23 100644 --- a/examples/amoeba/in.water_hexamer.hippo +++ b/examples/amoeba/in.water_hexamer.hippo @@ -24,6 +24,8 @@ read_data data.water_hexamer.hippo fix amtype NULL "Tinker Types" pair_style hippo pair_coeff * * hippo_water.prm hippo_water.key +special_bonds lj/coul 0.5 0.5 0.5 one/five yes + # thermo output compute virial all pressure NULL virial