Merge branch 'prerelease-3.2.1' into czarek

[unres.git] / examples / unres / MREMD / ff_gab / outputs / 1L2Y_MREMD_GB029.stat

diff --git a/examples/unres/MREMD/ff_gab/outputs/1L2Y_MREMD_GB029.stat b/examples/unres/MREMD/ff_gab/outputs/1L2Y_MREMD_GB029.stat
new file mode 100644 (file)
index 0000000..ed91d04
--- /dev/null
+++ b/examples/unres/MREMD/ff_gab/outputs/1L2Y_MREMD_GB029.stat
@@ -0,0 +1,101 @@
+         0           0.00      49.085      24.551      73.636  12.87 0.000   NaN   NaN 0.714     445.325     390.000      15.552   29 
+     10000        2000.00      43.938      -4.343      39.595   8.61 0.000 1.000 0.205 1.940     398.630     390.000      10.907   29 
+     20000        4000.00      33.518      -6.008      27.511   6.51 0.143 0.500 0.500 0.898     304.095     390.000       7.569   29 
+     30000        6000.00      40.947      -2.215      38.733   5.46 0.000 1.000 0.136 1.851     371.497     390.000       9.399   29 
+     40000        8000.00      34.561      -5.443      29.118   8.88 0.000 1.000 0.227 1.604     313.551     390.000      12.952   29 
+     50000       10000.00      44.912      -3.437      41.475   8.60 0.071 0.667 0.152 1.886     407.462     390.000      12.172   29 
+     60000       12000.00      35.209       2.271      37.480   7.77 0.000   NaN   NaN 2.318     319.436     390.000      12.889   29 
+     70000       14000.00      32.742       4.754      37.496   8.29 0.071 0.000 0.136 2.427     297.051     390.000      13.206   29 
+     80000       16000.00      46.039       7.569      53.608   5.87 0.071 0.000 0.182 1.918     417.687     390.000      10.069   29 
+     90000       18000.00      57.341       6.618      63.959   8.41 0.000   NaN   NaN 2.086     520.231     390.000      11.653   29 
+    100000       20000.00      38.999       1.621      40.620   6.72 0.071 0.667 0.303 2.209     353.819     390.000       8.500   29 
+    110000       22000.00      39.648      -6.382      33.266   5.69 0.000 1.000 0.455 2.589     359.706     380.000       8.947   29 
+    120000       24000.00      33.284      -5.549      27.735   9.35 0.000   NaN   NaN 2.840     301.969     380.000      13.493   29 
+    130000       26000.00      37.331       4.795      42.125   4.48 0.000 1.000 0.682 3.223     338.685     380.000       9.083   29 
+    140000       28000.00      30.484      21.724      52.208   8.00 0.000 1.000 0.250 1.948     276.570     380.000      11.342   29 
+    150000       30000.00      42.303       2.146      44.448   7.85 0.071 0.000 0.136 1.307     383.791     380.000      10.991   29 
+    160000       32000.00      41.595       0.590      42.185   7.73 0.000 1.000 0.250 1.269     377.375     380.000      12.165   29 
+    170000       34000.00      34.526      -0.453      34.073  10.55 0.000   NaN   NaN 1.967     313.237     380.000      13.068   29 
+    180000       36000.00      43.091      11.216      54.307  11.05 0.000 1.000 0.159 1.551     390.941     380.000      14.811   29 
+    190000       38000.00      33.160      -8.483      24.677   5.52 0.071 0.800 0.264 2.647     300.848     380.000       8.868   29 
+    200000       40000.00      42.779      -2.705      40.073   6.00 0.000   NaN   NaN 2.239     388.111     380.000       9.469   29 
+    210000       42000.00      30.071     -12.471      17.601   4.92 0.143 0.500 0.170 1.783     272.824     370.000       7.913   29 
+    220000       44000.00      42.088      -1.563      40.525   6.58 0.000   NaN   NaN 3.555     381.843     370.000      11.878   29 
+    230000       46000.00      41.881      -0.516      41.365   8.30 0.000 1.000 0.273 1.452     379.965     370.000      10.293   29 
+    240000       48000.00      37.597      -3.443      34.154   8.20 0.143 0.000 0.159 1.898     341.101     370.000      10.916   29 
+    250000       50000.00      36.000     -18.125      17.875   4.76 0.214 0.250 0.489 2.014     326.612     370.000       8.749   29 
+    260000       52000.00      33.959      -3.066      30.893  12.18 0.000   NaN   NaN 4.204     308.095     370.000      16.143   29 
+    270000       54000.00      31.546       8.757      40.304   5.50 0.000 1.000 0.136 2.031     286.202     370.000       8.883   29 
+    280000       56000.00      39.267       2.261      41.528   4.97 0.071 0.667 0.227 1.633     356.248     370.000       8.269   29 
+    290000       58000.00      33.125      -3.082      30.043   6.65 0.000 1.000 0.636 0.931     300.523     370.000       7.872   29 
+    300000       60000.00      39.269      -3.077      36.192   5.83 0.000 1.000 0.432 1.864     356.273     370.000       9.804   29 
+    310000       62000.00      30.409     -16.773      13.636   4.75 0.143 0.500 0.341 2.043     275.887     350.000       8.323   29 
+    320000       64000.00      38.932      -3.306      35.626   8.61 0.357 0.000 0.173 1.810     353.213     350.000      11.415   29 
+    330000       66000.00      32.212       4.187      36.399   6.20 0.071 0.500 0.432 1.326     292.244     350.000       7.816   29 
+    340000       68000.00      36.497     -19.133      17.363   5.14 0.143 0.750 0.261 1.842     331.116     350.000       8.255   29 
+    350000       70000.00      38.990      -9.051      29.940   5.76 0.000 1.000 0.364 1.665     353.741     350.000       8.736   29 
+    360000       72000.00      41.950      -3.119      38.831   8.28 0.071 0.500 0.159 1.810     380.592     350.000      12.312   29 
+    370000       74000.00      32.490       2.446      34.936   7.00 0.071 0.500 0.182 1.862     294.763     350.000      10.951   29 
+    380000       76000.00      35.892      -6.806      29.086   6.33 0.071 0.800 0.436 1.373     325.633     350.000       6.854   29 
+    390000       78000.00      33.795     -19.740      14.055   5.14 0.071 0.833 0.235 1.708     306.608     350.000       7.375   29 
+    400000       80000.00      33.847      -8.690      25.158   3.81 0.214 0.667 0.359 2.096     307.080     350.000       7.259   29 
+    410000       82000.00      32.322      -8.585      23.736  10.57 0.000   NaN   NaN 3.770     293.240     350.000      14.370   29 
+    420000       84000.00      38.209      -1.143      37.066   8.34 0.000 1.000 0.159 1.956     346.650     350.000      12.320   29 
+    430000       86000.00      29.320     -32.818      -3.498   4.99 0.143 0.600 0.318 1.585     266.009     350.000       7.506   29 
+    440000       88000.00      28.758      -9.042      19.716   5.40 0.071 0.800 0.227 1.358     260.903     350.000       8.411   29 
+    450000       90000.00      31.074      -0.754      30.321   6.28 0.000   NaN   NaN 1.270     281.922     350.000      10.116   29 
+    460000       92000.00      41.134      -6.965      34.170   6.03 0.000 1.000 0.330 1.884     373.190     350.000       9.973   29 
+    470000       94000.00      30.280     -12.816      17.465   4.82 0.143 0.333 0.303 2.141     274.719     350.000       9.747   29 
+    480000       96000.00      32.234     -16.880      15.353   8.61 0.143 0.000 0.159 2.594     292.442     350.000      13.090   29 
+    490000       98000.00      43.133       0.242      43.375   6.18 0.000 1.000 0.591 1.095     391.322     350.000       9.240   29 
+    500000      100000.00      47.558     -13.063      34.496   5.01 0.071 0.750 0.261 2.223     431.473     350.000       7.238   29 
+    510000      102000.00      30.693     -20.244      10.449   3.77 0.214 0.571 0.481 1.514     278.465     340.000       7.689   29 
+    520000      104000.00      39.462      -9.484      29.978   3.36 0.500 0.364 0.409 1.680     358.019     340.000       7.333   29 
+    530000      106000.00      38.247      -9.332      28.916   6.06 0.000 1.000 0.485 1.551     347.000     340.000       8.485   29 
+    540000      108000.00      40.911     -22.098      18.813   5.70 0.143 0.778 0.298 1.940     371.164     340.000       7.946   29 
+    550000      110000.00      32.343      -1.142      31.201   6.01 0.000 1.000 0.250 2.293     293.436     340.000       7.921   29 
+    560000      112000.00      29.401     -12.446      16.956   4.95 0.071 0.750 0.432 1.246     266.743     340.000       8.086   29 
+    570000      114000.00      31.003     -17.151      13.853   6.60 0.071 0.833 0.379 1.316     281.278     340.000       7.479   29 
+    580000      116000.00      25.510      -7.034      18.476   6.80 0.143 0.778 0.384 1.645     231.439     340.000       7.575   29 
+    590000      118000.00      27.784     -25.081       2.703   6.22 0.286 0.500 0.261 1.350     252.073     340.000       7.239   29 
+    600000      120000.00      31.124     -22.773       8.351   6.33 0.214 0.571 0.338 1.271     282.376     340.000       7.919   29 
+    610000      122000.00      29.796     -25.017       4.778   4.60 0.286 0.714 0.273 1.464     270.321     320.000       7.008   29 
+    620000      124000.00      37.013     -10.251      26.762   5.60 0.071 0.800 0.355 2.147     335.799     320.000       8.603   29 
+    630000      126000.00      29.223      -5.197      24.026  10.23 0.000   NaN   NaN 2.030     265.126     320.000      12.579   29 
+    640000      128000.00      29.292      -8.984      20.308   8.27 0.000 1.000 0.227 1.556     265.750     320.000      11.243   29 
+    650000      130000.00      30.510      -3.627      26.883   5.12 0.143 0.333 0.394 1.865     276.801     320.000       9.335   29 
+    660000      132000.00      36.700     -11.453      25.247   6.13 0.000 1.000 0.500 1.574     332.963     320.000      10.480   29 
+    670000      134000.00      26.232     -17.859       8.374   5.69 0.000   NaN   NaN 1.719     237.994     320.000       9.477   29 
+    680000      136000.00      29.392     -18.429      10.963   3.43 0.143 0.333 0.136 1.448     266.661     320.000       8.918   29 
+    690000      138000.00      33.448     -20.035      13.413   4.34 0.214 0.700 0.286 2.383     303.457     320.000       7.507   29 
+    700000      140000.00      25.858     -23.456       2.402   6.70 0.143 0.714 0.169 0.897     234.594     320.000       8.181   29 
+    710000      142000.00      31.635     -23.507       8.128   3.83 0.214 0.700 0.309 2.495     287.006     310.000       8.055   29 
+    720000      144000.00      37.668     -14.672      22.995   5.40 0.143 0.714 0.351 2.152     341.741     310.000       8.187   29 
+    730000      146000.00      29.094     -27.434       1.660   7.42 0.214 0.750 0.223 1.505     263.954     310.000       7.866   29 
+    740000      148000.00      27.983     -22.516       5.467   3.86 0.214 0.667 0.323 2.081     253.874     310.000       7.283   29 
+    750000      150000.00      30.319     -18.590      11.729   6.05 0.071 0.667 0.197 1.967     275.069     310.000       8.753   29 
+    760000      152000.00      33.613     -17.583      16.030   4.53 0.286 0.600 0.255 1.025     304.957     310.000       7.975   29 
+    770000      154000.00      22.457     -28.170      -5.714   4.93 0.214 0.727 0.388 2.220     203.738     310.000       7.053   29 
+    780000      156000.00      27.378     -24.745       2.632   5.07 0.214 0.500 0.311 1.208     248.385     310.000       7.429   29 
+    790000      158000.00      29.412     -29.455      -0.043   2.36 0.500 0.417 0.383 2.553     266.837     310.000       6.940   29 
+    800000      160000.00      33.265     -13.177      20.088   4.53 0.143 0.818 0.417 1.406     301.795     310.000       6.742   29 
+    810000      162000.00      30.232     -37.416      -7.184   4.67 0.357 0.583 0.197 1.824     274.280     310.000       7.645   29 
+    820000      164000.00      29.636     -13.336      16.299   5.71 0.143 0.600 0.227 2.014     268.871     310.000       9.051   29 
+    830000      166000.00      31.635     -26.235       5.400   5.19 0.214 0.500 0.242 1.546     287.006     310.000       7.959   29 
+    840000      168000.00      25.100     -16.162       8.938   5.39 0.143 0.714 0.383 1.693     227.721     310.000       9.145   29 
+    850000      170000.00      33.310     -19.980      13.330   5.85 0.214 0.250 0.602 2.639     302.207     310.000       8.763   29 
+    860000      172000.00      35.533     -23.436      12.097   6.43 0.143 0.714 0.182 1.581     322.376     310.000       9.875   29 
+    870000      174000.00      30.262     -25.338       4.923   3.68 0.214 0.700 0.414 1.684     274.550     310.000       7.298   29 
+    880000      176000.00      33.255     -24.034       9.221   5.70 0.071 0.889 0.318 1.424     301.704     310.000       7.603   29 
+    890000      178000.00      29.200     -18.693      10.508   6.43 0.071 0.833 0.280 2.678     264.920     310.000       9.610   29 
+    900000      180000.00      36.389     -23.564      12.825   3.67 0.071 0.800 0.191 1.742     330.139     310.000       7.483   29 
+    910000      182000.00      31.511     -15.694      15.817   5.31 0.214 0.625 0.250 1.249     285.882     310.000       7.430   29 
+    920000      184000.00      33.583     -13.395      20.188   6.59 0.143 0.500 0.170 2.607     304.681     310.000       9.753   29 
+    930000      186000.00      28.073     -20.157       7.915   6.76 0.143 0.667 0.242 1.532     254.689     310.000       7.557   29 
+    940000      188000.00      29.688     -21.928       7.761   6.00 0.143 0.600 0.300 1.371     269.346     310.000       8.471   29 
+    950000      190000.00      31.150     -18.930      12.219   5.18 0.214 0.500 0.235 1.430     282.605     310.000       7.408   29 
+    960000      192000.00      34.467     -32.730       1.737   4.91 0.214 0.750 0.348 2.309     312.698     310.000       6.771   29 
+    970000      194000.00      32.976     -25.085       7.892   4.66 0.214 0.625 0.335 1.672     299.178     310.000       7.847   29 
+    980000      196000.00      18.731     -36.105     -17.375   4.59 0.143 0.600 0.400 1.634     169.935     310.000       8.970   29 
+    990000      198000.00      31.287     -22.156       9.131   4.46 0.286 0.500 0.506 2.331     283.848     310.000       8.226   29 
+   1000000      200000.00      27.744     -27.210       0.534   4.41 0.286 0.692 0.318 1.261     251.707     310.000       7.114   29