Merge branch 'prerelease-3.2.1' into czarek

[unres.git] / examples / unres / new / MREMD / ff_gab / 1L2Y_MREMD_GB016.stat

diff --git a/examples/unres/new/MREMD/ff_gab/1L2Y_MREMD_GB016.stat b/examples/unres/new/MREMD/ff_gab/1L2Y_MREMD_GB016.stat
deleted file mode 100644 (file)
index 2d5e6f5..0000000
--- a/examples/unres/new/MREMD/ff_gab/1L2Y_MREMD_GB016.stat
+++ /dev/null
@@ -1,101 +0,0 @@
-         0           0.00      42.286      24.668      66.954  12.87 0.000   NaN   NaN 0.706     383.638     330.000      15.552   16 
-     10000        2000.00      33.995     -14.556      19.439   5.94 0.000 1.000 0.432 2.923     308.416     330.000       8.933   16 
-     20000        4000.00      27.910     -16.636      11.274   5.36 0.143 0.500 0.193 2.111     253.215     330.000       7.536   16 
-     30000        6000.00      32.844     -11.769      21.074  10.17 0.000 1.000 0.250 2.833     297.974     330.000      13.682   16 
-     40000        8000.00      33.879      -7.497      26.382   6.63 0.071 0.875 0.312 1.488     307.369     330.000       9.292   16 
-     50000       10000.00      36.704     -15.580      21.124   7.90 0.071 0.750 0.216 0.671     333.001     330.000      10.562   16 
-     60000       12000.00      36.977     -17.335      19.642   4.59 0.214 0.571 0.195 2.195     335.472     330.000       8.051   16 
-     70000       14000.00      24.479     -10.256      14.223   7.24 0.214 0.400 0.200 1.722     222.090     330.000       9.088   16 
-     80000       16000.00      32.518     -20.471      12.046   3.95 0.214 0.500 0.409 1.547     295.016     330.000       7.682   16 
-     90000       18000.00      29.159     -11.765      17.395   6.20 0.071 0.800 0.255 2.056     264.549     330.000       7.688   16 
-    100000       20000.00      29.393      -1.043      28.350   6.36 0.071 0.000 0.136 1.894     266.669     330.000      11.566   16 
-    110000       22000.00      40.318       0.577      40.895   9.13 0.000   NaN   NaN 1.130     365.789     390.000      11.691   16 
-    120000       24000.00      40.900       2.941      43.840   8.39 0.000 1.000 0.182 0.335     371.063     390.000      12.437   16 
-    130000       26000.00      46.549       4.849      51.398   8.95 0.000   NaN   NaN 2.121     422.319     390.000      12.891   16 
-    140000       28000.00      50.539      -8.812      41.728   4.80 0.071 0.750 0.364 2.232     458.519     390.000       8.653   16 
-    150000       30000.00      42.215       7.145      49.361   5.93 0.214 0.400 0.218 2.476     382.998     390.000       8.358   16 
-    160000       32000.00      32.637       2.953      35.590   5.00 0.071 0.667 0.394 2.055     296.100     390.000       8.851   16 
-    170000       34000.00      44.463       3.248      47.712   5.05 0.071 0.667 0.333 1.983     403.395     390.000       9.565   16 
-    180000       36000.00      52.370     -10.680      41.690   7.63 0.143 0.000 0.159 1.855     475.125     390.000      10.959   16 
-    190000       38000.00      34.329       5.898      40.227   8.74 0.000   NaN   NaN 2.530     311.453     390.000      13.166   16 
-    200000       40000.00      46.416      -0.437      45.979   8.38 0.071 0.500 0.159 0.967     421.110     390.000      10.974   16 
-    210000       42000.00      36.507      -3.343      33.164  12.63 0.000   NaN   NaN 3.810     331.209     370.000      16.160   16 
-    220000       44000.00      44.366      -1.684      42.682   9.47 0.000   NaN   NaN 1.039     402.511     370.000      13.931   16 
-    230000       46000.00      35.581      -1.111      34.471   7.85 0.071 0.500 0.205 3.628     322.812     370.000      10.181   16 
-    240000       48000.00      35.981      -6.322      29.660  12.55 0.000   NaN   NaN 2.378     326.440     370.000      16.210   16 
-    250000       50000.00      40.951      -1.212      39.740   6.87 0.143 0.333 0.227 2.520     371.533     370.000       9.910   16 
-    260000       52000.00      43.895       5.202      49.097   5.68 0.000 1.000 0.330 3.343     398.238     370.000       8.029   16 
-    270000       54000.00      38.274      -6.422      31.852  10.64 0.000   NaN   NaN 1.208     347.242     370.000      13.901   16 
-    280000       56000.00      30.822     -13.843      16.979   4.67 0.071 0.750 0.307 3.735     279.633     370.000       8.891   16 
-    290000       58000.00      39.314      11.522      50.836   8.58 0.000 1.000 0.318 2.985     356.681     370.000      10.872   16 
-    300000       60000.00      38.829       0.047      38.876   5.13 0.071 0.500 0.159 1.305     352.276     370.000       9.883   16 
-    310000       62000.00      39.142       1.051      40.192   8.36 0.071 0.667 0.212 1.439     355.115     360.000      10.849   16 
-    320000       64000.00      39.334      -3.921      35.413   7.64 0.071 0.500 0.205 2.762     356.857     360.000      10.705   16 
-    330000       66000.00      40.532       0.105      40.638   7.28 0.000 1.000 0.295 1.264     367.731     360.000       9.668   16 
-    340000       68000.00      32.940       2.577      35.517   5.43 0.071 0.750 0.432 2.444     298.844     360.000       8.920   16 
-    350000       70000.00      37.399      -3.803      33.596   4.16 0.071 0.667 0.318 1.648     339.302     360.000       7.974   16 
-    360000       72000.00      37.185       5.504      42.690   8.04 0.143 0.333 0.167 1.854     337.365     360.000      12.172   16 
-    370000       74000.00      34.281     -16.503      17.778  10.31 0.000   NaN   NaN 1.457     311.011     360.000      14.144   16 
-    380000       76000.00      34.803      -5.412      29.392   6.25 0.143 0.714 0.247 2.247     315.754     360.000       8.800   16 
-    390000       78000.00      47.736      -5.222      42.514   7.73 0.000 1.000 0.364 1.471     433.083     360.000      10.839   16 
-    400000       80000.00      39.054      -0.914      38.139   6.74 0.000 1.000 0.136 2.009     354.314     360.000      11.295   16 
-    410000       82000.00      45.196      -0.932      44.263   9.09 0.000 1.000 0.250 1.986     410.038     360.000      11.577   16 
-    420000       84000.00      31.950      -1.968      29.982  10.13 0.000   NaN   NaN 2.067     289.864     360.000      12.759   16 
-    430000       86000.00      32.667      -4.847      27.820   7.43 0.071 0.800 0.300 1.746     296.375     360.000       7.914   16 
-    440000       88000.00      30.883      -5.877      25.006   5.17 0.000 1.000 0.591 2.663     280.185     360.000       8.959   16 
-    450000       90000.00      32.429       3.297      35.725   4.63 0.000 1.000 0.364 2.295     294.208     360.000       8.832   16 
-    460000       92000.00      27.317     -16.367      10.949   4.79 0.071 0.875 0.267 1.707     247.830     360.000       8.877   16 
-    470000       94000.00      41.880       6.515      48.395   6.57 0.000   NaN   NaN 1.616     379.959     360.000      10.731   16 
-    480000       96000.00      42.935     -10.629      32.306   4.71 0.000 1.000 0.333 2.827     389.530     360.000       8.153   16 
-    490000       98000.00      35.763       1.166      36.929   5.67 0.071 0.800 0.555 1.825     324.457     360.000       8.306   16 
-    500000      100000.00      35.181       7.670      42.852   6.99 0.000 1.000 0.242 1.847     319.182     360.000       9.716   16 
-    510000      102000.00      36.611      -4.632      31.979   4.90 0.000   NaN   NaN 2.022     332.154     400.000       8.442   16 
-    520000      104000.00      37.679      -5.540      32.139   8.44 0.000   NaN   NaN 2.469     341.847     400.000      13.639   16 
-    530000      106000.00      40.914      10.005      50.919   9.06 0.000 1.000 0.227 2.667     371.193     400.000      11.383   16 
-    540000      108000.00      40.984     -10.265      30.719   5.93 0.214 0.500 0.205 1.820     371.826     400.000       8.687   16 
-    550000      110000.00      33.316      -4.084      29.233   6.77 0.000   NaN   NaN 1.228     302.262     400.000       9.704   16 
-    560000      112000.00      38.797      -0.949      37.848   7.43 0.143 0.000 0.159 1.573     351.982     400.000      10.308   16 
-    570000      114000.00      45.005      -7.737      37.268   8.13 0.000 1.000 0.295 1.268     408.312     400.000      11.657   16 
-    580000      116000.00      37.538       9.984      47.521   5.34 0.000   NaN   NaN 2.901     340.561     400.000      10.472   16 
-    590000      118000.00      32.073       9.457      41.530   6.39 0.000   NaN   NaN 1.511     290.983     400.000       8.870   16 
-    600000      120000.00      47.123      -4.736      42.387   7.98 0.000 1.000 0.182 1.743     427.526     400.000      12.324   16 
-    610000      122000.00      38.768       2.524      41.293   7.65 0.000   NaN   NaN 2.596     351.726     400.000      11.759   16 
-    620000      124000.00      32.499      -4.593      27.906   6.15 0.000 1.000 0.333 1.334     294.849     400.000       8.315   16 
-    630000      126000.00      43.860      16.636      60.496   8.94 0.071 0.000 0.136 2.211     397.920     400.000      13.743   16 
-    640000      128000.00      41.495      -8.790      32.705   8.06 0.000 1.000 0.212 1.396     376.466     400.000      11.252   16 
-    650000      130000.00      33.389       7.099      40.488   5.62 0.000 1.000 0.182 1.374     302.924     400.000       9.655   16 
-    660000      132000.00      39.886      -0.081      39.805   6.14 0.071 0.800 0.300 3.035     361.871     400.000       9.428   16 
-    670000      134000.00      34.070       9.590      43.659   8.51 0.000 1.000 0.159 2.974     309.097     400.000      11.228   16 
-    680000      136000.00      45.628       3.490      49.117   6.56 0.000   NaN   NaN 2.212     413.957     400.000      10.575   16 
-    690000      138000.00      30.413       3.786      34.199   4.92 0.071 0.000 0.136 2.442     275.922     400.000       8.162   16 
-    700000      140000.00      41.812       1.781      43.593   5.19 0.000 1.000 0.335 1.280     379.338     400.000       7.034   16 
-    710000      142000.00      42.262      -1.613      40.649   6.59 0.000 1.000 0.239 1.313     383.422     390.000       7.876   16 
-    720000      144000.00      36.081       9.663      45.744  10.62 0.071 0.000 0.136 4.552     327.347     390.000      13.929   16 
-    730000      146000.00      32.327      -0.990      31.336  11.26 0.071 0.500 0.159 2.297     293.283     390.000      14.673   16 
-    740000      148000.00      35.513       5.801      41.314   7.48 0.000   NaN   NaN 2.495     322.195     390.000      10.625   16 
-    750000      150000.00      38.443       6.076      44.519  10.71 0.000   NaN   NaN 1.503     348.771     390.000      14.455   16 
-    760000      152000.00      40.732      -4.829      35.903   7.25 0.000 1.000 0.318 2.097     369.542     390.000       8.575   16 
-    770000      154000.00      36.939       4.652      41.592   8.38 0.000   NaN   NaN 1.480     335.132     390.000      13.031   16 
-    780000      156000.00      40.897       3.110      44.007   4.83 0.000 1.000 0.409 1.379     371.035     390.000       9.349   16 
-    790000      158000.00      43.859      22.309      66.167  10.28 0.000 1.000 0.136 1.829     397.909     390.000      13.691   16 
-    800000      160000.00      32.466       5.460      37.926   9.19 0.071 0.000 0.136 1.105     294.547     390.000      12.743   16 
-    810000      162000.00      29.180       2.835      32.015   9.71 0.000 1.000 0.273 1.541     264.735     370.000      12.759   16 
-    820000      164000.00      40.259       1.188      41.447   6.53 0.000   NaN   NaN 1.673     365.251     370.000       9.596   16 
-    830000      166000.00      36.748     -13.275      23.473   5.17 0.143 0.333 0.500 1.775     333.401     370.000       7.706   16 
-    840000      168000.00      40.758      -8.663      32.095   6.17 0.071 0.500 0.182 1.185     369.775     370.000       9.253   16 
-    850000      170000.00      31.251      -3.629      27.622   6.08 0.000 1.000 0.500 2.524     283.527     370.000       7.421   16 
-    860000      172000.00      41.786      -8.225      33.561   6.62 0.000   NaN   NaN 1.921     379.104     370.000      10.311   16 
-    870000      174000.00      34.630       1.419      36.049   8.46 0.071 0.000 0.136 1.917     314.180     370.000      12.369   16 
-    880000      176000.00      37.090      -1.233      35.856   5.51 0.000   NaN   NaN 0.937     336.497     370.000       9.816   16 
-    890000      178000.00      32.385       5.788      38.173   4.32 0.214 0.000 0.364 2.918     293.813     370.000       8.759   16 
-    900000      180000.00      44.920     -14.119      30.801   5.21 0.143 0.714 0.357 2.451     407.539     370.000       8.419   16 
-    910000      182000.00      35.327       1.274      36.601   5.79 0.000 1.000 0.818 1.357     320.506     360.000       7.738   16 
-    920000      184000.00      26.741     -12.879      13.863   5.71 0.214 0.667 0.293 1.753     242.612     360.000       7.480   16 
-    930000      186000.00      40.362      -4.594      35.768   8.37 0.000   NaN   NaN 2.304     366.184     360.000      10.438   16 
-    940000      188000.00      26.357      -9.499      16.858   5.32 0.071 0.000 0.727 1.552     239.122     360.000       9.044   16 
-    950000      190000.00      32.788       0.090      32.878   5.14 0.000 1.000 0.136 1.403     297.469     360.000       9.332   16 
-    960000      192000.00      41.852     -12.510      29.341   6.34 0.071 0.833 0.182 1.508     379.702     360.000       8.779   16 
-    970000      194000.00      47.878      -2.420      45.457   5.29 0.071 0.750 0.489 2.033     434.371     360.000       8.586   16 
-    980000      196000.00      34.133       7.665      41.798   7.09 0.000 1.000 0.273 2.093     309.669     360.000       8.967   16 
-    990000      198000.00      45.150      -7.899      37.251   7.12 0.143 0.714 0.221 2.919     409.623     360.000       7.863   16 
-   1000000      200000.00      40.133     -10.104      30.030  10.49 0.071 0.000 0.136 1.462     364.110     360.000      13.937   16