Merge branch 'prerelease-3.2.1' into czarek

[unres.git] / examples / unres / new / REMD / Langevin / ff_gab / 1L2Y_REMD_GB010.stat

diff --git a/examples/unres/new/REMD/Langevin/ff_gab/1L2Y_REMD_GB010.stat b/examples/unres/new/REMD/Langevin/ff_gab/1L2Y_REMD_GB010.stat
deleted file mode 100644 (file)
index e454a7a..0000000
--- a/examples/unres/new/REMD/Langevin/ff_gab/1L2Y_REMD_GB010.stat
+++ /dev/null
@@ -1,101 +0,0 @@
-         0           0.00      40.911      24.593      65.504  12.87 0.000   NaN   NaN 0.708     371.162     350.000      15.552   10 
-     10000        2000.00      48.718      -4.695      44.022  12.31 0.000   NaN   NaN 2.724     441.992     350.000      16.463   10 
-     20000        4000.00      31.639      -9.259      22.380  10.07 0.000   NaN   NaN 1.205     287.043     350.000      14.371   10 
-     30000        6000.00      39.119     -20.432      18.687   9.15 0.000 1.000 0.258 1.429     354.907     350.000      13.011   10 
-     40000        8000.00      39.902       7.947      47.849   9.96 0.000 1.000 0.227 1.531     362.009     350.000      13.694   10 
-     50000       10000.00      38.258     -14.752      23.506   5.27 0.143 0.750 0.267 1.659     347.100     350.000       8.877   10 
-     60000       12000.00      35.838       0.423      36.261   7.80 0.071 0.500 0.205 3.506     325.138     350.000      12.119   10 
-     70000       14000.00      41.434      -3.988      37.447   7.40 0.071 0.667 0.167 2.503     375.913     350.000      11.111   10 
-     80000       16000.00      48.520      -9.025      39.495   7.79 0.071 0.500 0.227 1.350     440.195     350.000      11.460   10 
-     90000       18000.00      52.983     -12.752      40.231   7.12 0.071 0.667 0.258 2.856     480.686     350.000      10.502   10 
-    100000       20000.00      48.508       0.055      48.563  10.96 0.143 0.333 0.182 2.282     440.088     350.000      13.700   10 
-    110000       22000.00      35.223     -12.501      22.722   6.29 0.143 0.000 0.136 1.134     319.560     340.000      10.440   10 
-    120000       24000.00      36.654      -1.105      35.549   8.52 0.143 0.333 0.152 2.818     332.545     340.000      11.458   10 
-    130000       26000.00      28.521      -5.705      22.815   7.52 0.071 0.667 0.167 2.465     258.753     340.000      11.347   10 
-    140000       28000.00      39.139     -10.284      28.855   7.30 0.000 1.000 0.318 0.973     355.088     340.000      10.615   10 
-    150000       30000.00      44.108      -7.965      36.144   7.54 0.000   NaN   NaN 1.924     400.175     340.000       9.906   10 
-    160000       32000.00      32.576      -1.306      31.270   7.70 0.000 1.000 0.250 2.024     295.543     340.000       9.955   10 
-    170000       34000.00      41.542       2.846      44.388   8.13 0.000 1.000 0.307 3.480     376.890     340.000      10.128   10 
-    180000       36000.00      36.905       0.469      37.374   8.42 0.000 1.000 0.284 1.256     334.822     340.000      11.841   10 
-    190000       38000.00      46.807     -19.395      27.411   7.19 0.000 1.000 0.189 1.277     424.653     340.000       8.690   10 
-    200000       40000.00      44.578      -8.264      36.315   6.36 0.000 1.000 0.164 2.008     404.436     340.000       8.708   10 
-    210000       42000.00      43.200     -19.993      23.207   6.21 0.143 0.800 0.318 1.377     391.934     330.000       7.238   10 
-    220000       44000.00      34.778     -29.639       5.139   5.84 0.214 0.625 0.335 4.146     315.520     330.000       7.343   10 
-    230000       46000.00      41.710     -12.318      29.392   5.02 0.143 0.667 0.167 1.660     378.412     330.000       8.425   10 
-    240000       48000.00      31.807     -26.802       5.005   5.22 0.071 0.900 0.355 2.359     288.567     330.000       7.124   10 
-    250000       50000.00      36.636     -27.797       8.839   5.99 0.286 0.600 0.318 1.335     332.378     330.000       6.853   10 
-    260000       52000.00      47.519     -14.510      33.009   4.05 0.286 0.000 0.295 3.356     431.115     330.000       8.831   10 
-    270000       54000.00      38.622      -8.128      30.494   4.88 0.143 0.667 0.326 1.777     350.398     330.000       8.218   10 
-    280000       56000.00      33.516     -22.870      10.646   5.96 0.143 0.714 0.461 2.759     304.075     330.000       7.855   10 
-    290000       58000.00      43.394     -17.018      26.376   5.76 0.000 1.000 0.386 2.105     393.697     330.000       8.535   10 
-    300000       60000.00      35.707      -9.028      26.679   6.86 0.000 1.000 0.205 2.725     323.952     330.000       8.488   10 
-    310000       62000.00      35.860     -15.826      20.035   7.80 0.000 1.000 0.341 1.229     325.343     340.000       9.752   10 
-    320000       64000.00      36.585       3.792      40.377   7.07 0.071 0.667 0.182 2.089     331.917     340.000      10.770   10 
-    330000       66000.00      44.032     -10.475      33.557   7.80 0.000 1.000 0.227 1.750     399.486     340.000      11.047   10 
-    340000       68000.00      35.015      -2.687      32.328   6.64 0.000 1.000 0.273 1.030     317.672     340.000       9.490   10 
-    350000       70000.00      36.780      -1.396      35.384   8.26 0.071 0.500 0.136 1.544     333.688     340.000      11.731   10 
-    360000       72000.00      42.554       5.958      48.511  11.01 0.071 0.667 0.182 3.192     386.069     340.000      13.606   10 
-    370000       74000.00      44.590      -0.474      44.116  11.71 0.000   NaN   NaN 1.842     404.545     340.000      14.780   10 
-    380000       76000.00      42.872      -0.411      42.461  11.21 0.000 1.000 0.182 1.151     388.958     340.000      14.806   10 
-    390000       78000.00      36.639      -0.819      35.820  12.61 0.071 0.000 0.136 2.016     332.407     340.000      16.406   10 
-    400000       80000.00      35.482      -1.202      34.280  13.03 0.071 0.000 0.136 2.805     321.914     340.000      16.422   10 
-    410000       82000.00      37.701      -2.033      35.667  14.06 0.000   NaN   NaN 1.437     342.040     330.000      17.011   10 
-    420000       84000.00      50.343     -17.060      33.283  11.40 0.000 1.000 0.136 1.902     456.740     330.000      15.129   10 
-    430000       86000.00      33.708      -6.350      27.358   8.23 0.071 0.667 0.197 2.253     305.812     330.000      11.822   10 
-    440000       88000.00      35.690     -10.573      25.118   8.59 0.143 0.333 0.182 2.481     323.801     330.000      10.898   10 
-    450000       90000.00      43.504     -11.792      31.712   7.78 0.000 1.000 0.250 0.886     394.694     330.000      10.026   10 
-    460000       92000.00      39.594      -9.237      30.357  10.42 0.000   NaN   NaN 2.917     359.216     330.000      14.030   10 
-    470000       94000.00      31.068      -6.822      24.246   8.05 0.071 0.750 0.193 1.076     281.865     330.000      10.536   10 
-    480000       96000.00      41.567      -7.446      34.121   8.26 0.143 0.500 0.170 1.994     377.115     330.000      11.612   10 
-    490000       98000.00      33.963      -3.629      30.334   9.20 0.071 0.500 0.227 0.916     308.134     330.000      12.760   10 
-    500000      100000.00      41.797      -2.247      39.551  11.07 0.000 1.000 0.318 1.881     379.207     330.000      14.148   10 
-    510000      102000.00      50.217       5.924      56.141  11.12 0.071 0.000 0.182 3.200     455.596     380.000      13.907   10 
-    520000      104000.00      49.830      -2.495      47.335   7.89 0.143 0.600 0.173 1.519     452.083     380.000      10.841   10 
-    530000      106000.00      60.834       5.772      66.605   5.69 0.143 0.600 0.191 2.264     551.915     380.000       8.664   10 
-    540000      108000.00      39.222      -2.598      36.624   7.55 0.000 1.000 0.318 1.833     355.842     380.000      11.031   10 
-    550000      110000.00      35.921      -3.949      31.972   6.72 0.071 0.500 0.205 1.340     325.894     380.000      11.211   10 
-    560000      112000.00      39.357      -0.078      39.280   8.08 0.000 1.000 0.227 1.804     357.069     380.000      11.116   10 
-    570000      114000.00      49.409       9.863      59.272   5.99 0.071 0.750 0.239 2.290     448.263     380.000       9.965   10 
-    580000      116000.00      38.031       6.023      44.054   6.84 0.000   NaN   NaN 2.415     345.035     380.000      10.623   10 
-    590000      118000.00      39.359     -11.793      27.566   6.70 0.000 1.000 0.288 1.342     357.083     380.000       9.738   10 
-    600000      120000.00      35.022     -12.502      22.520   8.88 0.000 1.000 0.242 1.010     317.739     380.000      12.840   10 
-    610000      122000.00      43.113     -14.567      28.546   8.76 0.286 0.333 0.167 2.155     391.147     370.000      11.921   10 
-    620000      124000.00      47.562      -3.717      43.845   8.68 0.000   NaN   NaN 1.507     431.511     370.000      12.975   10 
-    630000      126000.00      39.074      -2.422      36.652   8.10 0.000   NaN   NaN 2.132     354.498     370.000      11.314   10 
-    640000      128000.00      43.680       7.980      51.660   7.89 0.071 0.500 0.159 2.801     396.290     370.000      11.046   10 
-    650000      130000.00      50.075      -3.040      47.034   8.30 0.071 0.667 0.227 1.307     454.302     370.000      11.451   10 
-    660000      132000.00      51.922      -2.699      49.222   8.18 0.071 0.000 0.182 2.445     471.061     370.000      12.400   10 
-    670000      134000.00      49.894       6.690      56.584   8.00 0.000 1.000 0.273 1.388     452.666     370.000      11.134   10 
-    680000      136000.00      39.981       0.716      40.697   9.54 0.000 1.000 0.136 1.528     362.729     370.000      12.604   10 
-    690000      138000.00      35.834      -1.168      34.666  11.33 0.071 0.000 0.136 1.141     325.108     370.000      15.262   10 
-    700000      140000.00      41.384       0.633      42.018  13.53 0.000   NaN   NaN 4.002     375.461     370.000      17.261   10 
-    710000      142000.00      44.571     -12.450      32.122   9.58 0.071 0.000 0.182 1.983     404.375     360.000      14.322   10 
-    720000      144000.00      34.340      -1.385      32.955   6.23 0.071 0.000 0.136 1.914     311.546     360.000      11.568   10 
-    730000      146000.00      40.693      -8.654      32.039   8.43 0.071 0.500 0.136 1.295     369.184     360.000      11.790   10 
-    740000      148000.00      33.279      -7.285      25.994   6.76 0.071 0.500 0.205 1.605     301.926     360.000       8.983   10 
-    750000      150000.00      54.278     -15.853      38.425   6.72 0.071 0.750 0.318 1.746     492.434     360.000       9.431   10 
-    760000      152000.00      42.776       2.411      45.187   6.01 0.000 1.000 0.182 1.697     388.090     360.000       9.278   10 
-    770000      154000.00      43.245      -0.195      43.049   6.47 0.071 0.800 0.482 1.038     392.339     360.000       8.284   10 
-    780000      156000.00      46.361      -1.804      44.557   6.31 0.000 1.000 0.455 4.022     420.612     360.000       7.367   10 
-    790000      158000.00      39.001       5.414      44.414   6.32 0.000 1.000 0.470 2.055     353.833     360.000       7.883   10 
-    800000      160000.00      50.979      -1.478      49.500   6.82 0.000 1.000 0.239 1.378     462.503     360.000       8.425   10 
-    810000      162000.00      41.963     -16.932      25.031   6.56 0.071 0.667 0.273 3.031     380.713     350.000       9.539   10 
-    820000      164000.00      34.922       7.715      42.637   7.84 0.000 1.000 0.227 2.391     316.832     350.000      11.354   10 
-    830000      166000.00      42.977       1.913      44.890   7.53 0.000 1.000 0.227 1.545     389.909     350.000      10.742   10 
-    840000      168000.00      37.972       4.928      42.900   7.23 0.143 0.333 0.152 2.084     344.505     350.000      10.314   10 
-    850000      170000.00      46.984     -14.152      32.832   8.23 0.071 0.500 0.295 2.546     426.259     350.000       9.881   10 
-    860000      172000.00      48.600     -17.871      30.730   9.22 0.143 0.000 0.159 1.011     440.927     350.000      11.663   10 
-    870000      174000.00      38.052      -3.073      34.979   6.85 0.071 0.800 0.300 1.641     345.228     350.000       9.164   10 
-    880000      176000.00      38.613      -9.252      29.361   6.31 0.071 0.800 0.291 2.928     350.318     350.000       9.382   10 
-    890000      178000.00      60.245       4.339      64.584   8.16 0.071 0.000 0.136 1.301     546.570     350.000      11.429   10 
-    900000      180000.00      39.837      -3.905      35.932   8.88 0.071 0.500 0.182 2.086     361.419     350.000      11.337   10 
-    910000      182000.00      37.222       0.818      38.039   7.33 0.000 1.000 0.227 1.439     337.693     340.000      10.572   10 
-    920000      184000.00      45.907     -10.996      34.911   6.38 0.071 0.800 0.209 1.504     416.494     340.000      10.210   10 
-    930000      186000.00      32.932      -6.542      26.390   7.75 0.071 0.500 0.159 2.045     298.780     340.000      10.738   10 
-    940000      188000.00      33.346      -8.789      24.557   7.06 0.143 0.500 0.193 2.282     302.536     340.000       9.967   10 
-    950000      190000.00      43.021      -9.600      33.421   8.27 0.000 1.000 0.227 2.512     390.305     340.000      11.776   10 
-    960000      192000.00      42.665     -11.503      31.162   5.21 0.000 1.000 0.197 1.489     387.079     340.000       9.596   10 
-    970000      194000.00      39.160       2.175      41.335   8.20 0.071 0.500 0.159 1.228     355.279     340.000      11.756   10 
-    980000      196000.00      43.081       4.019      47.100   8.38 0.071 0.500 0.182 1.102     390.850     340.000      11.986   10 
-    990000      198000.00      41.816      -9.966      31.850   8.53 0.071 0.667 0.152 3.537     379.375     340.000      12.460   10 
-   1000000      200000.00      41.860      -9.763      32.097  12.13 0.000   NaN   NaN 4.267     379.776     340.000      15.037   10