Merge branch 'prerelease-3.2.1' into czarek

[unres.git] / examples / unres / MREMD / ff_1l2y / outputs / 1L2Y_MREMD_GB024.stat

diff --git a/examples/unres/MREMD/ff_1l2y/outputs/1L2Y_MREMD_GB024.stat b/examples/unres/MREMD/ff_1l2y/outputs/1L2Y_MREMD_GB024.stat
new file mode 100644 (file)
index 0000000..9492840
--- /dev/null
+++ b/examples/unres/MREMD/ff_1l2y/outputs/1L2Y_MREMD_GB024.stat
@@ -0,0 +1,101 @@
+         0           0.00      42.090     112.930     155.019  12.87 0.000   NaN   NaN 4.850     381.858     370.000      15.552   24 
+     10000        2000.00      38.193       3.730      41.923   5.74 0.000 1.000 0.273 0.537     346.503     370.000       7.874   24 
+     20000        4000.00      38.652      12.298      50.950   6.83 0.143 0.500 0.170 0.275     350.671     370.000      10.499   24 
+     30000        6000.00      39.175       9.066      48.241   8.15 0.071 0.000 0.136 0.343     355.417     370.000      11.631   24 
+     40000        8000.00      44.934       1.052      45.986   8.13 0.143 0.333 0.152 0.359     407.667     370.000      11.703   24 
+     50000       10000.00      37.297       4.270      41.567   3.07 0.286 0.500 0.176 0.529     338.377     370.000       7.864   24 
+     60000       12000.00      42.591       1.888      44.479   7.50 0.000 1.000 0.352 0.730     386.407     370.000       7.855   24 
+     70000       14000.00      36.514      -3.358      33.156   6.28 0.286 0.556 0.470 0.392     331.273     370.000       6.953   24 
+     80000       16000.00      44.968       1.860      46.829   4.44 0.214 0.700 0.295 0.288     407.977     370.000       7.731   24 
+     90000       18000.00      27.441      18.639      46.080   5.55 0.000   NaN   NaN 0.305     248.960     370.000       9.138   24 
+    100000       20000.00      38.036       0.259      38.295   7.87 0.214 0.667 0.283 0.202     345.083     370.000       8.131   24 
+    110000       22000.00      39.010       0.121      39.131   5.22 0.071 0.800 0.218 0.297     353.918     370.000       9.392   24 
+    120000       24000.00      37.232      -1.260      35.973   5.65 0.143 0.667 0.136 0.229     337.791     370.000       9.337   24 
+    130000       26000.00      38.735      11.139      49.874   5.55 0.000 1.000 0.182 0.929     351.425     370.000       8.879   24 
+    140000       28000.00      33.771      15.357      49.127   8.35 0.000 1.000 0.205 0.731     306.384     370.000      12.463   24 
+    150000       30000.00      43.939       5.463      49.401   8.45 0.071 0.667 0.197 0.142     398.635     370.000       9.293   24 
+    160000       32000.00      35.858       8.153      44.011   9.16 0.000 1.000 0.159 1.043     325.318     370.000      12.122   24 
+    170000       34000.00      51.711      -4.657      47.054   6.05 0.143 0.667 0.280 0.706     469.145     370.000       7.130   24 
+    180000       36000.00      44.342       4.098      48.441   4.23 0.071 0.857 0.617 1.134     402.295     370.000       7.790   24 
+    190000       38000.00      30.366      16.587      46.953   6.05 0.000 1.000 0.136 1.100     275.496     370.000       9.885   24 
+    200000       40000.00      38.316       3.303      41.618   5.15 0.071 0.667 0.197 0.620     347.620     370.000       9.027   24 
+    210000       42000.00      41.493      10.589      52.082   7.93 0.071 0.500 0.182 0.454     376.445     400.000      10.061   24 
+    220000       44000.00      37.696      11.835      49.531   6.24 0.000 1.000 0.477 0.641     342.001     400.000       7.932   24 
+    230000       46000.00      36.265      13.428      49.693   6.86 0.143 0.600 0.173 0.591     329.011     400.000      10.651   24 
+    240000       48000.00      45.837      18.723      64.560   5.03 0.000 1.000 0.591 0.518     415.859     400.000       8.489   24 
+    250000       50000.00      56.612      12.514      69.126   6.11 0.214 0.250 0.182 0.842     513.616     400.000       9.528   24 
+    260000       52000.00      33.470       5.788      39.257   6.51 0.000 1.000 0.398 0.364     303.656     400.000       9.373   24 
+    270000       54000.00      38.861      13.303      52.164   6.59 0.071 0.750 0.250 0.538     352.566     400.000       9.080   24 
+    280000       56000.00      46.208       3.336      49.544   6.13 0.143 0.714 0.299 0.352     419.221     400.000       9.156   24 
+    290000       58000.00      34.625       3.197      37.822   6.42 0.000 1.000 0.252 0.781     314.133     400.000       8.459   24 
+    300000       60000.00      39.630      17.245      56.875   7.83 0.071 0.667 0.152 0.463     359.542     400.000      10.801   24 
+    310000       62000.00      44.813       6.832      51.645   5.71 0.000 1.000 0.455 0.657     406.563     390.000       7.428   24 
+    320000       64000.00      36.603       9.761      46.364   6.54 0.071 0.500 0.159 0.540     332.077     390.000      11.421   24 
+    330000       66000.00      31.399       4.485      35.885   7.00 0.071 0.667 0.197 0.844     284.871     390.000      10.730   24 
+    340000       68000.00      38.149      19.147      57.296  13.28 0.000   NaN   NaN 0.240     346.109     390.000      16.803   24 
+    350000       70000.00      44.561      10.519      55.080   8.77 0.143 0.000 0.159 0.697     404.280     390.000      11.975   24 
+    360000       72000.00      39.873       6.035      45.908   5.35 0.000 1.000 0.182 0.685     361.750     390.000       9.827   24 
+    370000       74000.00      41.318      17.567      58.884   7.95 0.071 0.667 0.242 0.735     374.857     390.000       9.641   24 
+    380000       76000.00      51.520      11.632      63.152   6.17 0.286 0.333 0.159 0.351     467.420     390.000      10.519   24 
+    390000       78000.00      38.672      12.291      50.963   5.18 0.071 0.750 0.261 0.519     350.850     390.000       8.549   24 
+    400000       80000.00      37.926      17.095      55.020   8.17 0.000   NaN   NaN 0.552     344.080     390.000      12.783   24 
+    410000       82000.00      42.237      18.582      60.819   5.83 0.071 0.500 0.250 0.755     383.196     390.000       9.055   24 
+    420000       84000.00      35.007       7.565      42.572  10.23 0.071 0.800 0.164 0.769     317.601     390.000      12.984   24 
+    430000       86000.00      39.184      -1.239      37.944   6.66 0.071 0.833 0.280 0.628     355.493     390.000       8.907   24 
+    440000       88000.00      40.199      15.031      55.230   7.72 0.000   NaN   NaN 0.234     364.705     390.000      11.792   24 
+    450000       90000.00      43.746      12.708      56.454   5.94 0.071 0.800 0.200 0.518     396.888     390.000       9.466   24 
+    460000       92000.00      41.246       5.175      46.421   6.79 0.000 1.000 0.341 0.513     374.204     390.000       8.625   24 
+    470000       94000.00      31.135      21.879      53.014   6.95 0.071 0.667 0.258 0.506     282.474     390.000      10.249   24 
+    480000       96000.00      43.589      11.639      55.227   8.06 0.000 1.000 0.136 0.931     395.458     390.000      12.131   24 
+    490000       98000.00      35.970      13.582      49.552   5.32 0.000   NaN   NaN 1.068     326.335     390.000       9.809   24 
+    500000      100000.00      38.690       1.839      40.529   5.09 0.143 0.667 0.462 0.562     351.016     390.000       8.142   24 
+    510000      102000.00      44.770      15.354      60.124   6.66 0.071 0.000 0.136 0.664     406.173     390.000      11.061   24 
+    520000      104000.00      48.265      14.237      62.502   4.32 0.143 0.600 0.255 0.844     437.886     390.000       7.619   24 
+    530000      106000.00      38.835      19.914      58.749   6.64 0.000 1.000 0.258 0.944     352.329     390.000       8.901   24 
+    540000      108000.00      49.566      10.773      60.339   8.75 0.214 0.000 0.182 0.371     449.685     390.000      12.072   24 
+    550000      110000.00      37.404       8.437      45.841   6.29 0.143 0.333 0.167 0.577     339.346     390.000      10.350   24 
+    560000      112000.00      44.765      18.213      62.978   8.76 0.000 1.000 0.136 0.226     406.127     390.000      11.462   24 
+    570000      114000.00      33.175      12.105      45.280   9.10 0.071 0.000 0.136 0.994     300.977     390.000      11.574   24 
+    580000      116000.00      39.474      -2.833      36.641   4.55 0.143 0.667 0.273 0.164     358.133     390.000       7.970   24 
+    590000      118000.00      27.918       8.613      36.532   5.73 0.000 1.000 0.136 0.479     253.291     390.000       8.146   24 
+    600000      120000.00      31.452      16.490      47.941   6.17 0.000   NaN   NaN 0.433     285.348     390.000      10.805   24 
+    610000      122000.00      45.747       4.302      50.049   7.13 0.071 0.833 0.273 0.841     415.041     380.000       7.776   24 
+    620000      124000.00      28.004      -6.436      21.568   5.22 0.071 0.875 0.415 0.442     254.067     380.000       7.323   24 
+    630000      126000.00      41.545       7.572      49.116   6.77 0.071 0.857 0.435 0.220     376.914     380.000       8.824   24 
+    640000      128000.00      30.852      14.981      45.833   6.16 0.214 0.250 0.148 0.579     279.906     380.000       8.474   24 
+    650000      130000.00      39.786       4.897      44.683   4.79 0.000 1.000 0.227 0.757     360.960     380.000       8.206   24 
+    660000      132000.00      41.159       7.562      48.721   7.64 0.000 1.000 0.182 0.534     373.411     380.000      10.906   24 
+    670000      134000.00      43.779      14.740      58.519   5.61 0.071 0.750 0.216 0.504     397.185     380.000       9.257   24 
+    680000      136000.00      39.472       1.053      40.525   5.27 0.071 0.750 0.318 0.852     358.114     380.000       9.298   24 
+    690000      138000.00      38.363       8.849      47.212   5.52 0.143 0.500 0.409 0.920     348.045     380.000       7.905   24 
+    700000      140000.00      39.719       0.053      39.773   5.93 0.071 0.750 0.352 0.327     360.354     380.000       7.592   24 
+    710000      142000.00      39.612       9.221      48.833   5.48 0.214 0.250 0.182 0.564     359.377     370.000       9.203   24 
+    720000      144000.00      35.220       7.907      43.128   5.04 0.000 1.000 0.273 0.379     319.538     370.000       7.824   24 
+    730000      146000.00      32.817       9.645      42.462   4.26 0.071 0.800 0.345 0.661     297.729     370.000       7.838   24 
+    740000      148000.00      34.529       5.107      39.636   7.41 0.071 0.000 0.136 0.392     313.269     370.000       9.447   24 
+    750000      150000.00      44.860       5.940      50.799   4.03 0.286 0.667 0.303 0.891     406.989     370.000       6.647   24 
+    760000      152000.00      38.549      10.227      48.776   7.43 0.071 0.800 0.273 0.528     349.736     370.000       8.311   24 
+    770000      154000.00      35.974       5.878      41.851   9.33 0.143 0.600 0.191 0.472     326.370     370.000      11.466   24 
+    780000      156000.00      35.583      11.134      46.717   5.71 0.071 0.750 0.182 0.300     322.832     370.000       9.323   24 
+    790000      158000.00      42.568       9.114      51.681   7.48 0.071 0.000 0.136 0.385     386.195     370.000      11.460   24 
+    800000      160000.00      39.439       6.550      45.989   6.23 0.071 0.667 0.212 0.524     357.808     370.000       8.817   24 
+    810000      162000.00      35.876      15.839      51.715   8.04 0.143 0.000 0.159 0.588     325.488     360.000      11.140   24 
+    820000      164000.00      39.806       8.616      48.422   6.43 0.071 0.800 0.364 1.018     361.140     360.000       8.465   24 
+    830000      166000.00      45.628       8.343      53.971   8.20 0.000 1.000 0.136 0.641     413.963     360.000      11.859   24 
+    840000      168000.00      39.457       2.810      42.267   7.83 0.071 0.800 0.200 0.371     357.973     360.000       9.221   24 
+    850000      170000.00      28.790       8.516      37.306   7.22 0.071 0.667 0.242 0.353     261.202     360.000       9.925   24 
+    860000      172000.00      44.379      -7.169      37.209   4.95 0.214 0.571 0.318 0.674     402.627     360.000       7.402   24 
+    870000      174000.00      36.886       6.412      43.298   6.52 0.143 0.667 0.189 0.838     334.648     360.000      10.341   24 
+    880000      176000.00      42.813       4.276      47.089   5.51 0.071 0.889 0.263 0.693     388.423     360.000       8.145   24 
+    890000      178000.00      39.801       9.729      49.530   5.60 0.071 0.800 0.518 0.814     361.094     360.000       8.455   24 
+    900000      180000.00      31.937       9.710      41.648   6.68 0.071 0.667 0.197 0.278     289.753     360.000      10.164   24 
+    910000      182000.00      32.202       5.481      37.682   8.13 0.000 1.000 0.273 0.485     292.150     350.000      11.463   24 
+    920000      184000.00      36.338       4.202      40.540   7.98 0.071 0.750 0.239 0.508     329.676     350.000       9.178   24 
+    930000      186000.00      36.882       3.008      39.889   4.61 0.143 0.750 0.415 0.541     334.609     350.000       7.783   24 
+    940000      188000.00      38.242       6.153      44.394   6.41 0.071 0.667 0.273 0.251     346.947     350.000       9.091   24 
+    950000      190000.00      36.096      -2.885      33.211   6.28 0.071 0.500 0.205 0.393     327.482     350.000       8.498   24 
+    960000      192000.00      40.342      -0.397      39.944   4.31 0.143 0.600 0.291 0.720     366.001     350.000       7.871   24 
+    970000      194000.00      37.999      -7.250      30.749   6.79 0.071 0.909 0.298 0.172     344.746     350.000       7.279   24 
+    980000      196000.00      40.345      -1.219      39.125   5.00 0.214 0.500 0.174 0.512     366.028     350.000       9.307   24 
+    990000      198000.00      37.406      14.542      51.948   9.43 0.000 1.000 0.136 0.312     339.363     350.000      12.325   24 
+   1000000      200000.00      30.844       9.114      39.958   4.78 0.143 0.750 0.284 0.491     279.832     350.000       7.588   24