Merge branch 'prerelease-3.2.1' into czarek

[unres.git] / examples / unres / REMD / Berendsen / ff_1l2y / outputs / 1L2Y_REMD_GB015.stat

diff --git a/examples/unres/REMD/Berendsen/ff_1l2y/outputs/1L2Y_REMD_GB015.stat b/examples/unres/REMD/Berendsen/ff_1l2y/outputs/1L2Y_REMD_GB015.stat
new file mode 100644 (file)
index 0000000..7f90b1e
--- /dev/null
+++ b/examples/unres/REMD/Berendsen/ff_1l2y/outputs/1L2Y_REMD_GB015.stat
@@ -0,0 +1,101 @@
+         0           0.00      41.798     112.326     154.124  12.87 0.000   NaN   NaN 4.849     379.213     400.000      15.552   15 
+     10000        2000.00      36.481       2.629      39.110   5.28 0.000 1.000 0.336 0.360     330.977     400.000       8.100   15 
+     20000        4000.00      33.911      14.373      48.284   8.25 0.071 0.500 0.159 0.428     307.656     400.000      11.923   15 
+     30000        6000.00      35.277      16.013      51.290   5.53 0.071 0.667 0.136 0.342     320.052     400.000       9.773   15 
+     40000        8000.00      40.496       7.210      47.706   5.64 0.071 0.800 0.327 1.509     367.400     400.000       7.500   15 
+     50000       10000.00      42.569      14.168      56.737   5.13 0.214 0.500 0.242 1.678     386.208     400.000       8.569   15 
+     60000       12000.00      42.324      15.227      57.551   4.72 0.071 0.500 0.159 0.475     383.981     400.000       9.504   15 
+     70000       14000.00      41.895      15.342      57.236   6.13 0.000 1.000 0.265 0.368     380.091     400.000       9.496   15 
+     80000       16000.00      40.415      12.793      53.208   5.30 0.071 0.875 0.347 0.744     366.665     400.000       9.640   15 
+     90000       18000.00      31.837      -0.585      31.252   5.28 0.071 0.800 0.545 0.733     288.841     400.000       7.012   15 
+    100000       20000.00      46.395       8.493      54.888   7.25 0.143 0.714 0.221 0.473     420.924     400.000       9.819   15 
+    110000       22000.00      39.169       4.215      43.385   4.68 0.143 0.667 0.591 0.863     355.365     390.000       8.586   15 
+    120000       24000.00      36.246       2.670      38.916   6.89 0.071 0.875 0.312 0.327     328.839     390.000       7.378   15 
+    130000       26000.00      45.124      13.603      58.728   6.19 0.000   NaN   NaN 0.325     409.391     390.000       9.946   15 
+    140000       28000.00      37.594      13.639      51.233   5.56 0.000 1.000 0.250 0.483     341.077     390.000       9.249   15 
+    150000       30000.00      39.852       7.591      47.442   5.74 0.071 0.667 0.182 0.718     361.553     390.000      10.341   15 
+    160000       32000.00      44.960      11.037      55.997   5.54 0.071 0.750 0.216 0.296     407.898     390.000       8.081   15 
+    170000       34000.00      49.051       0.662      49.713   6.76 0.000 1.000 0.273 0.436     445.019     390.000       7.862   15 
+    180000       36000.00      43.639      16.522      60.160   6.82 0.000   NaN   NaN 0.786     395.912     390.000      11.625   15 
+    190000       38000.00      37.909       8.679      46.588   5.07 0.143 0.778 0.237 1.711     343.932     390.000       7.489   15 
+    200000       40000.00      34.731      12.936      47.667   5.64 0.071 0.833 0.318 0.827     315.095     390.000       8.327   15 
+    210000       42000.00      47.486      10.570      58.056   7.85 0.071 0.500 0.159 0.628     430.818     380.000      10.942   15 
+    220000       44000.00      34.347      10.805      45.152   5.92 0.214 0.500 0.220 0.749     311.614     380.000       8.652   15 
+    230000       46000.00      44.041      17.220      61.260  10.87 0.071 0.500 0.136 0.287     399.559     380.000      13.677   15 
+    240000       48000.00      42.299      12.559      54.858   4.94 0.143 0.600 0.309 0.447     383.761     380.000       8.063   15 
+    250000       50000.00      34.627      14.634      49.261   7.52 0.071 0.000 0.136 0.287     314.151     380.000      10.173   15 
+    260000       52000.00      40.054      20.291      60.345   5.66 0.071 0.500 0.159 0.496     363.391     380.000       8.241   15 
+    270000       54000.00      41.810      12.196      54.006   7.68 0.071 0.833 0.341 1.348     379.322     380.000       8.483   15 
+    280000       56000.00      36.228       3.507      39.734   6.40 0.071 0.857 0.325 0.366     328.675     380.000       7.505   15 
+    290000       58000.00      42.695      15.530      58.226   6.35 0.071 0.500 0.182 0.476     387.355     380.000       9.373   15 
+    300000       60000.00      35.509       0.720      36.228   5.25 0.143 0.778 0.409 0.708     322.153     380.000       7.011   15 
+    310000       62000.00      40.789       3.538      44.327   7.49 0.071 0.667 0.152 0.790     370.063     370.000       8.975   15 
+    320000       64000.00      37.661       2.298      39.959   5.61 0.071 0.800 0.300 1.343     341.681     370.000       8.457   15 
+    330000       66000.00      44.634       6.946      51.580   5.02 0.143 0.500 0.216 0.624     404.940     370.000       8.374   15 
+    340000       68000.00      32.019      -0.862      31.157   5.95 0.143 0.778 0.500 0.255     290.493     370.000       7.543   15 
+    350000       70000.00      30.719       6.407      37.126   5.88 0.143 0.500 0.148 0.281     278.701     370.000       9.191   15 
+    360000       72000.00      29.668     -13.297      16.371   5.90 0.071 0.875 0.449 0.415     269.163     370.000       7.291   15 
+    370000       74000.00      40.225       3.576      43.801   6.33 0.071 0.800 0.191 0.558     364.944     370.000       8.953   15 
+    380000       76000.00      36.040      13.517      49.556   5.07 0.143 0.500 0.205 0.617     326.970     370.000       8.260   15 
+    390000       78000.00      34.788       7.172      41.960   7.15 0.000 1.000 0.136 0.474     315.615     370.000      10.213   15 
+    400000       80000.00      36.081       5.007      41.089   4.91 0.071 0.500 0.159 0.743     327.349     370.000       9.029   15 
+    410000       82000.00      42.380      12.412      54.792   7.92 0.143 0.500 0.193 1.008     384.490     360.000      11.441   15 
+    420000       84000.00      42.477      12.856      55.334   6.99 0.071 0.800 0.255 0.428     385.377     360.000      10.258   15 
+    430000       86000.00      33.890      11.434      45.324   9.78 0.071 0.667 0.167 0.944     307.469     360.000      11.993   15 
+    440000       88000.00      36.215      -2.404      33.812   7.11 0.000 1.000 0.295 0.977     328.565     360.000       8.579   15 
+    450000       90000.00      29.727      -2.205      27.522   5.18 0.143 0.714 0.227 0.454     269.698     360.000       8.316   15 
+    460000       92000.00      45.071       7.380      52.450   5.84 0.071 0.857 0.357 0.758     408.904     360.000       8.110   15 
+    470000       94000.00      39.700       4.229      43.929   4.89 0.214 0.625 0.347 0.947     360.182     360.000       8.114   15 
+    480000       96000.00      33.443      -5.195      28.248   5.05 0.143 0.750 0.335 0.620     303.412     360.000       7.040   15 
+    490000       98000.00      35.388      -6.199      29.189   3.82 0.143 0.818 0.355 0.285     321.057     360.000       7.246   15 
+    500000      100000.00      34.571       4.123      38.694   5.05 0.000 1.000 0.424 0.353     313.647     360.000       8.313   15 
+    510000      102000.00      36.625       6.688      43.313   7.40 0.143 0.600 0.145 0.388     332.279     350.000       8.682   15 
+    520000      104000.00      39.033       1.205      40.237   3.99 0.143 0.714 0.396 0.441     354.123     350.000       8.152   15 
+    530000      106000.00      35.780       3.830      39.610   6.94 0.071 0.857 0.266 0.536     324.615     350.000       8.136   15 
+    540000      108000.00      34.918      -1.408      33.510   4.52 0.143 0.846 0.346 0.494     316.790     350.000       6.682   15 
+    550000      110000.00      42.879       2.536      45.415   4.54 0.214 0.769 0.413 0.239     389.017     350.000       6.829   15 
+    560000      112000.00      30.158      -5.252      24.905   4.12 0.071 0.750 0.239 1.188     273.605     350.000       8.502   15 
+    570000      114000.00      41.282       6.013      47.295   7.31 0.000 1.000 0.159 1.031     374.534     350.000      10.422   15 
+    580000      116000.00      31.968       8.423      40.392   8.03 0.071 0.833 0.265 0.823     290.034     350.000      10.676   15 
+    590000      118000.00      42.040      -8.041      33.999   5.23 0.000 1.000 0.212 0.923     381.412     350.000       8.213   15 
+    600000      120000.00      33.971      -4.525      29.446   5.03 0.071 0.857 0.344 0.735     308.202     350.000       7.192   15 
+    610000      122000.00      33.489      -3.220      30.269   4.74 0.071 0.750 0.216 0.185     303.829     340.000       8.951   15 
+    620000      124000.00      35.653       5.838      41.490   4.83 0.071 0.667 0.348 0.657     323.458     340.000       8.398   15 
+    630000      126000.00      36.924       0.049      36.972   4.52 0.214 0.700 0.255 0.620     334.989     340.000       6.767   15 
+    640000      128000.00      38.311      -3.272      35.038   6.37 0.071 0.750 0.205 0.823     347.573     340.000      10.278   15 
+    650000      130000.00      33.551      -1.109      32.443   5.46 0.143 0.800 0.405 0.555     304.396     340.000       7.586   15 
+    660000      132000.00      25.535      -0.438      25.097   4.89 0.071 0.750 0.375 1.478     231.670     340.000       8.372   15 
+    670000      134000.00      29.827      -1.519      28.308   5.32 0.071 0.800 0.200 0.763     270.607     340.000       8.966   15 
+    680000      136000.00      34.045       4.474      38.519   6.15 0.071 0.500 0.159 0.300     308.877     340.000      10.010   15 
+    690000      138000.00      29.249      -5.279      23.970   6.01 0.214 0.667 0.313 0.780     265.366     340.000       8.678   15 
+    700000      140000.00      35.280      -8.787      26.493   6.48 0.071 0.929 0.390 0.180     320.075     340.000       7.088   15 
+    710000      142000.00      33.492       7.669      41.161   6.60 0.071 0.800 0.273 0.349     303.860     330.000       8.170   15 
+    720000      144000.00      34.798     -20.778      14.020   6.28 0.143 0.778 0.313 0.680     315.706     330.000       7.670   15 
+    730000      146000.00      39.856     -10.212      29.644   6.87 0.071 0.933 0.394 0.687     361.590     330.000       7.057   15 
+    740000      148000.00      35.030      -4.495      30.535   4.93 0.000 1.000 0.351 0.419     317.809     330.000       7.156   15 
+    750000      150000.00      37.354      -7.459      29.895   4.62 0.071 0.833 0.432 0.702     338.891     330.000       7.386   15 
+    760000      152000.00      30.733       2.999      33.732   6.77 0.000 1.000 0.227 0.982     278.830     330.000       9.525   15 
+    770000      154000.00      34.738       3.796      38.533   6.15 0.071 0.833 0.250 0.541     315.159     330.000       7.677   15 
+    780000      156000.00      36.693      -2.988      33.705   5.53 0.071 0.889 0.222 0.676     332.898     330.000       7.786   15 
+    790000      158000.00      40.013     -10.180      29.834   5.30 0.286 0.600 0.295 0.751     363.022     330.000       7.091   15 
+    800000      160000.00      30.220      -0.798      29.422   4.57 0.143 0.818 0.335 0.429     274.168     330.000       7.527   15 
+    810000      162000.00      35.916       2.409      38.325   4.53 0.071 0.750 0.352 0.259     325.850     350.000       7.639   15 
+    820000      164000.00      39.045       8.751      47.796   6.22 0.071 0.667 0.182 0.185     354.240     350.000       9.899   15 
+    830000      166000.00      39.043      -1.241      37.802   6.68 0.214 0.571 0.279 0.823     354.218     350.000       7.633   15 
+    840000      168000.00      35.993      12.977      48.970   7.07 0.071 0.750 0.227 0.539     326.543     350.000       9.242   15 
+    850000      170000.00      42.943      -0.191      42.752   5.56 0.214 0.250 0.284 0.552     389.601     350.000       7.996   15 
+    860000      172000.00      47.511      -0.502      47.009   6.77 0.143 0.714 0.260 1.015     431.044     350.000       8.506   15 
+    870000      174000.00      39.134      10.867      50.001   5.41 0.214 0.571 0.351 0.593     355.044     350.000       7.733   15 
+    880000      176000.00      40.686       3.706      44.392   5.22 0.214 0.625 0.199 0.363     369.121     350.000       8.485   15 
+    890000      178000.00      42.401      -2.433      39.968   4.73 0.071 0.833 0.280 0.396     384.685     350.000       7.476   15 
+    900000      180000.00      34.599       3.351      37.950   6.10 0.071 0.800 0.191 0.797     313.903     350.000       9.093   15 
+    910000      182000.00      31.231       1.569      32.800   7.07 0.071 0.667 0.227 0.701     283.343     340.000       9.387   15 
+    920000      184000.00      32.507       7.715      40.222   6.66 0.071 0.875 0.409 0.428     294.921     340.000       8.385   15 
+    930000      186000.00      28.885      -6.859      22.026   5.01 0.143 0.750 0.375 0.511     262.064     340.000       7.057   15 
+    940000      188000.00      44.875       7.417      52.291   6.83 0.000 1.000 0.167 1.244     407.128     340.000       9.745   15 
+    950000      190000.00      32.091      -3.612      28.480   5.70 0.214 0.000 0.136 0.873     291.148     340.000       9.314   15 
+    960000      192000.00      41.133     -13.274      27.859   5.73 0.000 1.000 0.288 0.292     373.181     340.000       7.421   15 
+    970000      194000.00      29.128      -0.160      28.969   6.69 0.214 0.625 0.295 0.532     264.267     340.000       7.803   15 
+    980000      196000.00      38.750      10.585      49.335   8.03 0.143 0.600 0.164 0.301     351.560     340.000      10.312   15 
+    990000      198000.00      31.703       1.242      32.945   5.73 0.286 0.556 0.323 0.971     287.626     340.000       7.702   15 
+   1000000      200000.00      37.612       5.369      42.981   5.57 0.143 0.667 0.280 0.651     341.236     340.000       7.832   15