diff --git a/regtest/basic/rt-pesmd/Makefile b/regtest/basic/rt-pesmd/Makefile deleted file mode 100644 index 3703b27cea227aa053fb6d1d73f861e4384dbcee..0000000000000000000000000000000000000000 --- a/regtest/basic/rt-pesmd/Makefile +++ /dev/null @@ -1 +0,0 @@ -include ../../scripts/test.make diff --git a/regtest/basic/rt-pesmd/colv.reference b/regtest/basic/rt-pesmd/colv.reference deleted file mode 100644 index 72a923f4e5431272ba5f63ca5541653849c36dfc..0000000000000000000000000000000000000000 --- a/regtest/basic/rt-pesmd/colv.reference +++ /dev/null @@ -1,52 +0,0 @@ -#! FIELDS time d1.x rr.bias rr.force2 - 0.000000 0.1000 0.0100 0.0400 - 0.005000 0.0993 0.0099 0.0394 - 0.010000 0.0989 0.0098 0.0391 - 0.015000 0.0984 0.0097 0.0387 - 0.020000 0.0986 0.0097 0.0389 - 0.025000 0.0985 0.0097 0.0388 - 0.030000 0.0985 0.0097 0.0388 - 0.035000 0.0981 0.0096 0.0385 - 0.040000 0.0980 0.0096 0.0384 - 0.045000 0.0976 0.0095 0.0381 - 0.050000 0.0965 0.0093 0.0373 - 0.055000 0.0951 0.0091 0.0362 - 0.060000 0.0938 0.0088 0.0352 - 0.065000 0.0916 0.0084 0.0336 - 0.070000 0.0894 0.0080 0.0320 - 0.075000 0.0882 0.0078 0.0311 - 0.080000 0.0877 0.0077 0.0308 - 0.085000 0.0878 0.0077 0.0308 - 0.090000 0.0874 0.0076 0.0306 - 0.095000 0.0868 0.0075 0.0301 - 0.100000 0.0860 0.0074 0.0296 - 0.105000 0.0856 0.0073 0.0293 - 0.110000 0.0847 0.0072 0.0287 - 0.115000 0.0841 0.0071 0.0283 - 0.120000 0.0837 0.0070 0.0280 - 0.125000 0.0828 0.0069 0.0274 - 0.130000 0.0817 0.0067 0.0267 - 0.135000 0.0801 0.0064 0.0256 - 0.140000 0.0777 0.0060 0.0242 - 0.145000 0.0764 0.0058 0.0233 - 0.150000 0.0755 0.0057 0.0228 - 0.155000 0.0743 0.0055 0.0221 - 0.160000 0.0727 0.0053 0.0212 - 0.165000 0.0723 0.0052 0.0209 - 0.170000 0.0717 0.0051 0.0206 - 0.175000 0.0713 0.0051 0.0204 - 0.180000 0.0709 0.0050 0.0201 - 0.185000 0.0713 0.0051 0.0203 - 0.190000 0.0718 0.0052 0.0206 - 0.195000 0.0717 0.0051 0.0206 - 0.200000 0.0719 0.0052 0.0207 - 0.205000 0.0722 0.0052 0.0209 - 0.210000 0.0724 0.0052 0.0210 - 0.215000 0.0726 0.0053 0.0211 - 0.220000 0.0727 0.0053 0.0211 - 0.225000 0.0730 0.0053 0.0213 - 0.230000 0.0738 0.0054 0.0218 - 0.235000 0.0747 0.0056 0.0223 - 0.240000 0.0754 0.0057 0.0227 - 0.245000 0.0767 0.0059 0.0236 - 0.250000 0.0768 0.0059 0.0236 diff --git a/regtest/basic/rt-pesmd/config b/regtest/basic/rt-pesmd/config deleted file mode 100644 index f65c8c59ba5f92e99416b6591eea47fb66fa7ec6..0000000000000000000000000000000000000000 --- a/regtest/basic/rt-pesmd/config +++ /dev/null @@ -1,2 +0,0 @@ -type=plumed -arg="pesmd input.dat" diff --git a/regtest/basic/rt-pesmd/input.dat b/regtest/basic/rt-pesmd/input.dat deleted file mode 100644 index 2a8df08091964057e0a3899c698dad29b59fc199..0000000000000000000000000000000000000000 --- a/regtest/basic/rt-pesmd/input.dat +++ /dev/null @@ -1,7 +0,0 @@ -temperature 0.1 -friction 0.1 -tstep 0.005 -dimension 1 -nstep 50 -ipos 0.1 -periodic false diff --git a/regtest/basic/rt-pesmd/plumed.dat b/regtest/basic/rt-pesmd/plumed.dat deleted file mode 100644 index da2d0d818199f54ea4c6da925e77c14cc16b80b6..0000000000000000000000000000000000000000 --- a/regtest/basic/rt-pesmd/plumed.dat +++ /dev/null @@ -1,3 +0,0 @@ -d1: DISTANCE ATOMS=1,2 COMPONENTS -rr: RESTRAINT ARG=d1.x AT=0.0 KAPPA=2 -PRINT ARG=d1.x,rr.* FILE=colv FMT=%8.4f