Merge branch 'prerelease-3.2.1' into czarek

[unres.git] / examples / unres / MREMD / ff_1l2y / outputs / 1L2Y_MREMD_GB029.stat

diff --git a/examples/unres/MREMD/ff_1l2y/outputs/1L2Y_MREMD_GB029.stat b/examples/unres/MREMD/ff_1l2y/outputs/1L2Y_MREMD_GB029.stat
new file mode 100644 (file)
index 0000000..d60a0f5
--- /dev/null
+++ b/examples/unres/MREMD/ff_1l2y/outputs/1L2Y_MREMD_GB029.stat
@@ -0,0 +1,101 @@
+         0           0.00      49.085     112.507     161.592  12.87 0.000   NaN   NaN 4.850     445.325     390.000      15.552   29 
+     10000        2000.00      44.870      18.178      63.048   7.37 0.000 1.000 0.205 0.757     407.084     390.000      10.336   29 
+     20000        4000.00      36.126      -0.509      35.617   5.33 0.071 0.833 0.371 0.322     327.752     390.000       8.199   29 
+     30000        6000.00      40.267       8.185      48.452   6.27 0.143 0.778 0.227 0.369     365.319     390.000       7.852   29 
+     40000        8000.00      37.156      17.671      54.827   5.93 0.071 0.500 0.136 0.852     337.099     390.000       9.237   29 
+     50000       10000.00      43.814       5.740      49.555   7.14 0.000 1.000 0.273 0.598     397.507     390.000      10.095   29 
+     60000       12000.00      38.011      14.250      52.262   5.78 0.143 0.333 0.288 0.312     344.860     390.000       9.008   29 
+     70000       14000.00      39.409      14.035      53.444   6.36 0.071 0.500 0.295 0.889     357.538     390.000       9.534   29 
+     80000       16000.00      55.023       7.498      62.521   7.52 0.071 0.500 0.205 0.773     499.196     390.000       9.534   29 
+     90000       18000.00      57.715       9.213      66.928   6.18 0.071 0.667 0.303 0.398     523.620     390.000       9.296   29 
+    100000       20000.00      45.507      21.070      66.577   7.69 0.071 0.833 0.212 1.012     412.861     390.000       9.496   29 
+    110000       22000.00      36.124      -2.008      34.116   4.18 0.143 0.846 0.318 0.453     327.734     380.000       6.696   29 
+    120000       24000.00      32.195      -2.923      29.272   5.00 0.143 0.000 0.136 0.478     292.089     380.000       8.907   29 
+    130000       26000.00      42.627       4.176      46.803   5.81 0.071 0.800 0.327 1.473     386.734     380.000       8.282   29 
+    140000       28000.00      33.552       3.831      37.383   7.03 0.071 0.667 0.152 0.301     304.397     380.000       9.699   29 
+    150000       30000.00      41.740       8.471      50.211   6.49 0.071 0.857 0.377 0.372     378.684     380.000       7.531   29 
+    160000       32000.00      39.400      -0.526      38.875   4.97 0.000 1.000 0.455 0.691     357.462     380.000       8.597   29 
+    170000       34000.00      38.756      18.095      56.852   7.41 0.071 0.800 0.209 0.650     351.618     380.000       9.060   29 
+    180000       36000.00      42.136       8.854      50.990   6.69 0.071 0.750 0.170 1.180     382.279     380.000       9.758   29 
+    190000       38000.00      29.676      13.221      42.897   5.64 0.071 0.750 0.318 1.063     269.232     380.000       8.719   29 
+    200000       40000.00      42.577      11.911      54.488   6.98 0.071 0.800 0.227 1.362     386.281     380.000       7.861   29 
+    210000       42000.00      29.274       5.184      34.458   5.90 0.000 1.000 0.485 0.595     265.590     390.000       8.603   29 
+    220000       44000.00      44.808      15.908      60.716   6.49 0.071 0.500 0.136 0.556     406.521     390.000      11.675   29 
+    230000       46000.00      46.242       6.904      53.146  10.90 0.000 1.000 0.136 0.389     419.532     390.000      14.801   29 
+    240000       48000.00      37.856      13.745      51.601   9.24 0.143 0.333 0.152 0.875     343.453     390.000      12.672   29 
+    250000       50000.00      38.551       2.910      41.461   6.45 0.071 0.800 0.309 0.746     349.752     390.000       7.978   29 
+    260000       52000.00      43.838      10.661      54.498   6.13 0.000 1.000 0.318 0.460     397.719     390.000       9.258   29 
+    270000       54000.00      44.880       9.583      54.462   4.61 0.071 0.800 0.345 0.527     407.170     390.000       7.513   29 
+    280000       56000.00      40.031       3.723      43.754   4.48 0.000 1.000 0.209 0.762     363.183     390.000       8.907   29 
+    290000       58000.00      39.986      16.285      56.271   5.46 0.214 0.500 0.174 0.369     362.776     390.000       8.803   29 
+    300000       60000.00      45.671       3.349      49.021   5.15 0.214 0.500 0.227 0.602     414.353     390.000       8.271   29 
+    310000       62000.00      28.239       0.462      28.701   5.83 0.000 1.000 0.273 0.489     256.195     380.000       9.914   29 
+    320000       64000.00      47.397       4.399      51.796   6.25 0.071 0.800 0.191 0.279     430.006     380.000       9.976   29 
+    330000       66000.00      39.544      17.782      57.325   4.56 0.000 1.000 0.364 0.970     358.761     380.000       8.975   29 
+    340000       68000.00      44.714       7.204      51.918   8.60 0.071 0.667 0.152 0.658     405.670     380.000      11.913   29 
+    350000       70000.00      42.030      15.469      57.498   5.54 0.143 0.500 0.511 0.533     381.315     380.000       7.941   29 
+    360000       72000.00      43.676      10.103      53.779   5.17 0.214 0.625 0.267 0.266     396.252     380.000       8.235   29 
+    370000       74000.00      35.654       8.667      44.321   5.42 0.071 0.667 0.152 0.618     323.473     380.000       9.030   29 
+    380000       76000.00      34.094      23.110      57.205   5.01 0.214 0.500 0.212 0.484     309.323     380.000       8.669   29 
+    390000       78000.00      32.776       4.154      36.930   5.30 0.000 1.000 0.318 0.668     297.357     380.000       7.903   29 
+    400000       80000.00      43.389      20.007      63.396  10.38 0.071 0.500 0.182 0.271     393.649     380.000      13.476   29 
+    410000       82000.00      34.816      13.006      47.822   9.66 0.000 1.000 0.136 0.739     315.870     380.000      12.759   29 
+    420000       84000.00      44.436       6.898      51.333  10.11 0.071 0.667 0.212 0.447     403.144     380.000      12.392   29 
+    430000       86000.00      32.482      13.264      45.746   4.37 0.143 0.600 0.236 1.518     294.696     380.000       7.311   29 
+    440000       88000.00      34.252      12.723      46.975   7.62 0.000 1.000 0.159 0.455     310.754     380.000      10.584   29 
+    450000       90000.00      37.609       5.946      43.555   8.67 0.000 1.000 0.258 0.596     341.211     380.000      11.075   29 
+    460000       92000.00      41.535       8.722      50.257   5.18 0.000 1.000 0.205 0.538     376.826     380.000       9.608   29 
+    470000       94000.00      34.991      13.719      48.710   8.63 0.071 0.000 0.136 0.491     317.459     380.000      13.230   29 
+    480000       96000.00      34.632       8.265      42.897   6.61 0.071 0.750 0.273 0.213     314.202     380.000       7.849   29 
+    490000       98000.00      38.886       6.471      45.357   6.37 0.000   NaN   NaN 0.570     352.792     380.000      10.046   29 
+    500000      100000.00      52.126       4.116      56.242   6.93 0.000 1.000 0.182 0.438     472.914     380.000       9.952   29 
+    510000      102000.00      33.535       5.215      38.750   6.82 0.000 1.000 0.227 0.245     304.243     370.000       8.976   29 
+    520000      104000.00      47.797      13.349      61.145   5.89 0.071 0.500 0.205 0.902     433.635     370.000       9.752   29 
+    530000      106000.00      46.327      13.149      59.477   5.69 0.071 0.500 0.477 0.805     420.307     370.000       9.202   29 
+    540000      108000.00      39.530       9.735      49.264   6.72 0.000 1.000 0.455 0.386     358.633     370.000       8.191   29 
+    550000      110000.00      36.832      10.211      47.043   4.75 0.071 0.800 0.391 0.553     334.159     370.000       7.976   29 
+    560000      112000.00      34.276       7.594      41.869   6.57 0.000 1.000 0.159 0.386     310.966     370.000      10.443   29 
+    570000      114000.00      31.040       9.967      41.007   7.67 0.000 1.000 0.364 1.058     281.608     370.000       9.742   29 
+    580000      116000.00      33.752      14.224      47.976   5.11 0.071 0.800 0.482 0.691     306.216     370.000       8.434   29 
+    590000      118000.00      23.484       9.771      33.255   9.24 0.000   NaN   NaN 0.676     213.061     370.000      13.846   29 
+    600000      120000.00      34.690      11.211      45.901   5.68 0.071 0.500 0.205 0.688     314.724     370.000      10.072   29 
+    610000      122000.00      33.473       6.452      39.925   5.86 0.143 0.000 0.136 0.205     303.686     370.000       9.279   29 
+    620000      124000.00      38.714      20.436      59.150   5.61 0.071 0.750 0.182 0.679     351.236     370.000       9.312   29 
+    630000      126000.00      32.752       5.831      38.584   5.37 0.071 0.750 0.182 0.383     297.148     370.000       9.086   29 
+    640000      128000.00      35.038      10.797      45.836   7.22 0.071 0.667 0.182 0.440     317.887     370.000      10.075   29 
+    650000      130000.00      37.899       9.769      47.668   9.17 0.143 0.500 0.170 1.294     343.841     370.000      12.839   29 
+    660000      132000.00      46.223      13.735      59.958   8.87 0.071 0.000 0.136 0.905     419.360     370.000      11.494   29 
+    670000      134000.00      34.445      -2.407      32.038   7.50 0.143 0.500 0.159 0.486     312.500     370.000      10.862   29 
+    680000      136000.00      35.764       1.059      36.823   5.18 0.000 1.000 0.245 0.569     324.470     370.000       8.051   29 
+    690000      138000.00      44.559      -2.866      41.693   5.52 0.143 0.667 0.500 0.763     404.261     370.000       7.859   29 
+    700000      140000.00      29.638       7.312      36.950   7.66 0.000 1.000 0.258 0.688     268.891     370.000       9.523   29 
+    710000      142000.00      40.620      -0.895      39.725   4.80 0.214 0.250 0.295 0.397     368.526     370.000       8.111   29 
+    720000      144000.00      47.256       0.879      48.135   5.00 0.071 0.667 0.364 0.653     428.727     370.000       8.841   29 
+    730000      146000.00      39.439       4.018      43.458   4.76 0.000 1.000 0.280 0.857     357.814     370.000       8.184   29 
+    740000      148000.00      36.760      -4.189      32.571   7.01 0.071 0.857 0.357 0.420     333.507     370.000       8.411   29 
+    750000      150000.00      36.692       7.130      43.822   3.69 0.214 0.500 0.152 0.328     332.892     370.000       8.424   29 
+    760000      152000.00      37.981      -0.760      37.221   3.84 0.000 1.000 0.318 0.472     344.581     370.000       8.234   29 
+    770000      154000.00      31.833      -1.538      30.295   6.94 0.143 0.500 0.148 0.403     288.804     370.000      10.694   29 
+    780000      156000.00      38.905      17.841      56.745   7.04 0.071 0.833 0.288 0.866     352.962     370.000       8.136   29 
+    790000      158000.00      40.501      14.042      54.543   9.11 0.071 0.500 0.182 0.291     367.446     370.000      11.409   29 
+    800000      160000.00      41.812       4.381      46.194   4.20 0.143 0.750 0.477 0.384     379.344     370.000       7.786   29 
+    810000      162000.00      35.501      -3.021      32.480   8.02 0.071 0.750 0.170 0.287     322.086     360.000       9.322   29 
+    820000      164000.00      32.265      -1.646      30.619   3.81 0.071 0.800 0.227 0.575     292.725     360.000       7.653   29 
+    830000      166000.00      37.888       1.409      39.298   6.69 0.071 0.923 0.441 0.536     343.744     360.000       7.201   29 
+    840000      168000.00      33.016      -7.299      25.717   7.36 0.214 0.727 0.306 0.534     299.541     360.000       7.280   29 
+    850000      170000.00      44.637      -6.667      37.969   7.40 0.071 0.900 0.264 0.928     404.967     360.000       8.602   29 
+    860000      172000.00      44.818      -0.725      44.092   5.82 0.000 1.000 0.343 0.528     406.609     360.000       6.967   29 
+    870000      174000.00      34.870      16.064      50.933   6.28 0.143 0.600 0.173 0.342     316.355     360.000       9.646   29 
+    880000      176000.00      37.024       5.931      42.955   4.91 0.143 0.333 0.318 1.149     335.899     360.000       7.965   29 
+    890000      178000.00      35.262      -9.781      25.481   7.10 0.071 0.875 0.278 0.392     319.918     360.000       8.760   29 
+    900000      180000.00      43.618       5.681      49.299   7.02 0.071 0.917 0.246 0.374     395.722     360.000       7.884   29 
+    910000      182000.00      39.659     -13.685      25.974   3.90 0.071 0.833 0.189 0.414     359.803     360.000       7.869   29 
+    920000      184000.00      36.796      -9.340      27.457   4.79 0.214 0.667 0.192 0.245     333.833     360.000       7.959   29 
+    930000      186000.00      30.486       8.097      38.583   5.17 0.143 0.000 0.159 0.343     276.585     360.000       8.695   29 
+    940000      188000.00      37.925       9.355      47.280   7.79 0.071 0.667 0.197 0.854     344.077     360.000      10.073   29 
+    950000      190000.00      38.430      10.014      48.443   5.67 0.071 0.800 0.227 0.837     348.655     360.000       8.820   29 
+    960000      192000.00      41.562      -4.103      37.459   5.16 0.214 0.667 0.177 1.049     377.069     360.000       8.481   29 
+    970000      194000.00      43.411       1.862      45.273   9.06 0.071 0.500 0.159 0.838     393.850     360.000      11.988   29 
+    980000      196000.00      22.008      -7.349      14.659   4.63 0.143 0.714 0.377 0.207     199.671     360.000       7.248   29 
+    990000      198000.00      38.602       3.416      42.018   7.85 0.071 0.500 0.136 0.698     350.218     360.000      10.794   29 
+   1000000      200000.00      34.031      10.164      44.194   5.50 0.071 0.750 0.182 0.646     308.744     360.000       8.756   29