Merge branch 'prerelease-3.2.1' into czarek

[unres.git] / examples / unres / new / MREMD / ff_1l2y / 1L2Y_MREMD_GB061.stat

diff --git a/examples/unres/new/MREMD/ff_1l2y/1L2Y_MREMD_GB061.stat b/examples/unres/new/MREMD/ff_1l2y/1L2Y_MREMD_GB061.stat
deleted file mode 100644 (file)
index b36768b..0000000
--- a/examples/unres/new/MREMD/ff_1l2y/1L2Y_MREMD_GB061.stat
+++ /dev/null
@@ -1,101 +0,0 @@
-         0           0.00      32.571     112.326     144.897  12.87 0.000   NaN   NaN 4.849     295.503     400.000      15.552   61 
-     10000        2000.00      39.775      16.733      56.508   4.08 0.000 1.000 0.173 0.366     360.857     400.000       9.159   61 
-     20000        4000.00      35.393      16.258      51.651   5.71 0.143 0.333 0.227 0.444     321.105     400.000       9.257   61 
-     30000        6000.00      46.923       7.558      54.481   7.87 0.143 0.667 0.182 0.675     425.712     400.000       9.677   61 
-     40000        8000.00      42.849      12.698      55.546   4.73 0.000 1.000 0.396 0.479     388.745     400.000       7.978   61 
-     50000       10000.00      32.851      25.412      58.263   6.79 0.071 0.000 0.136 0.852     298.042     400.000      10.728   61 
-     60000       12000.00      34.697      15.057      49.754   6.45 0.000 1.000 0.291 0.372     314.786     400.000       7.897   61 
-     70000       14000.00      40.838      19.420      60.259   7.96 0.071 0.750 0.284 0.464     370.506     400.000       9.742   61 
-     80000       16000.00      36.462      15.746      52.208  10.00 0.000   NaN   NaN 0.550     330.801     400.000      12.900   61 
-     90000       18000.00      38.967      17.987      56.955   5.00 0.000   NaN   NaN 0.476     353.532     400.000       9.600   61 
-    100000       20000.00      47.891      11.058      58.949   5.79 0.000 1.000 0.352 0.399     434.491     400.000       7.647   61 
-    110000       22000.00      47.842      16.812      64.654   4.50 0.071 0.857 0.338 0.370     434.050     400.000       8.695   61 
-    120000       24000.00      32.435      18.088      50.523   5.92 0.071 0.500 0.159 0.796     294.264     400.000       9.277   61 
-    130000       26000.00      48.352      14.962      63.314   5.85 0.071 0.857 0.390 0.712     438.675     400.000       8.035   61 
-    140000       28000.00      45.418      11.801      57.219   6.79 0.143 0.500 0.250 0.588     412.052     400.000       8.614   61 
-    150000       30000.00      43.655      11.493      55.148   5.96 0.000 1.000 0.386 0.416     396.062     400.000       8.874   61 
-    160000       32000.00      48.895       9.198      58.093   4.93 0.143 0.667 0.447 0.619     443.602     400.000       8.217   61 
-    170000       34000.00      51.091      24.625      75.717   4.93 0.071 0.800 0.182 0.643     463.525     400.000       8.831   61 
-    180000       36000.00      42.137       9.111      51.248   8.46 0.143 0.333 0.152 1.249     382.288     400.000      11.849   61 
-    190000       38000.00      46.667      -0.177      46.490   5.33 0.000   NaN   NaN 0.736     423.383     400.000       8.324   61 
-    200000       40000.00      36.551      14.390      50.941   6.12 0.143 0.333 0.182 0.260     331.610     400.000       9.411   61 
-    210000       42000.00      36.088      12.484      48.572   4.55 0.071 0.000 0.136 0.621     327.410     400.000       8.795   61 
-    220000       44000.00      46.267      20.858      67.125   8.18 0.000 1.000 0.182 0.300     419.756     400.000      11.832   61 
-    230000       46000.00      41.022      13.436      54.457   7.23 0.071 0.750 0.273 0.364     372.169     400.000       9.962   61 
-    240000       48000.00      42.872      10.614      53.486   8.69 0.071 0.800 0.209 0.159     388.953     400.000      12.175   61 
-    250000       50000.00      47.871      23.266      71.137   8.08 0.000   NaN   NaN 0.601     434.308     400.000      10.837   61 
-    260000       52000.00      46.938      18.731      65.669   6.74 0.071 0.000 0.136 0.357     425.845     400.000      10.204   61 
-    270000       54000.00      31.762      13.332      45.094   5.20 0.000 1.000 0.564 0.334     288.164     400.000       9.468   61 
-    280000       56000.00      34.028       6.896      40.925   5.29 0.071 0.800 0.273 0.488     308.722     400.000       8.638   61 
-    290000       58000.00      36.643       5.255      41.898   5.44 0.000 1.000 0.341 0.758     332.440     400.000      10.386   61 
-    300000       60000.00      41.037       0.593      41.630   6.25 0.071 0.750 0.193 0.622     372.308     400.000       8.528   61 
-    310000       62000.00      41.521       6.459      47.979   6.69 0.071 0.857 0.201 0.608     376.698     400.000       8.655   61 
-    320000       64000.00      37.988       9.793      47.781   4.82 0.143 0.750 0.455 0.277     344.642     400.000       7.598   61 
-    330000       66000.00      50.520      18.244      68.764   5.00 0.143 0.750 0.330 0.656     458.348     400.000       8.801   61 
-    340000       68000.00      41.520       2.940      44.460   5.52 0.071 0.875 0.352 0.565     376.690     400.000       7.415   61 
-    350000       70000.00      38.332      23.772      62.104   6.33 0.000 1.000 0.345 0.404     347.770     400.000       7.283   61 
-    360000       72000.00      41.192      13.719      54.911   9.00 0.000   NaN   NaN 0.690     373.719     400.000      11.679   61 
-    370000       74000.00      41.024      12.709      53.733   6.79 0.000 1.000 0.295 0.961     372.187     400.000       8.300   61 
-    380000       76000.00      47.250      13.120      60.370   5.53 0.143 0.714 0.325 0.539     428.677     400.000       7.733   61 
-    390000       78000.00      40.014       2.632      42.646   6.00 0.143 0.714 0.390 0.420     363.027     400.000       7.485   61 
-    400000       80000.00      33.610      21.264      54.874   9.59 0.000   NaN   NaN 1.318     304.927     400.000      11.503   61 
-    410000       82000.00      49.302      14.391      63.693   7.57 0.071 0.800 0.309 0.499     447.296     400.000       7.863   61 
-    420000       84000.00      38.658      18.701      57.359   6.68 0.000 1.000 0.242 0.288     350.729     400.000      10.134   61 
-    430000       86000.00      38.984      11.395      50.379   7.06 0.071 0.667 0.258 0.398     353.687     400.000       7.877   61 
-    440000       88000.00      39.188       9.807      48.995   6.78 0.071 0.667 0.152 0.652     355.534     400.000       9.920   61 
-    450000       90000.00      33.969      12.119      46.088   5.86 0.071 0.667 0.197 0.306     308.183     400.000       9.477   61 
-    460000       92000.00      46.408       4.461      50.869   8.74 0.071 0.667 0.197 1.119     421.040     400.000      10.859   61 
-    470000       94000.00      41.029      12.818      53.848   7.15 0.143 0.000 0.136 1.198     372.241     400.000      10.002   61 
-    480000       96000.00      36.577      14.595      51.172   6.32 0.143 0.667 0.197 0.593     331.849     400.000       9.152   61 
-    490000       98000.00      37.966       8.163      46.129   6.32 0.071 0.889 0.409 0.310     344.449     400.000       8.494   61 
-    500000      100000.00      45.924      14.922      60.846  10.01 0.000 1.000 0.136 0.995     416.649     400.000      13.602   61 
-    510000      102000.00      46.476      18.356      64.832   6.21 0.071 0.800 0.173 1.128     421.654     400.000       9.986   61 
-    520000      104000.00      45.986       3.412      49.398   6.49 0.143 0.600 0.173 0.651     417.210     400.000       8.325   61 
-    530000      106000.00      38.162       7.297      45.459   7.64 0.071 0.750 0.205 0.174     346.229     400.000      10.013   61 
-    540000      108000.00      42.935      11.993      54.928   6.42 0.071 0.833 0.212 0.604     389.524     400.000       9.461   61 
-    550000      110000.00      35.027      11.418      46.445   6.83 0.071 0.889 0.293 0.467     317.784     400.000       7.699   61 
-    560000      112000.00      47.505      20.391      67.896   8.58 0.071 0.500 0.159 0.209     430.993     400.000      10.858   61 
-    570000      114000.00      40.693      24.049      64.743   6.10 0.071 0.800 0.355 0.851     369.189     400.000       8.719   61 
-    580000      116000.00      39.850       7.283      47.133   4.96 0.000 1.000 0.205 0.591     361.539     400.000       8.208   61 
-    590000      118000.00      42.525       9.146      51.671   7.21 0.000 1.000 0.167 0.464     385.806     400.000       9.593   61 
-    600000      120000.00      45.477       6.024      51.501   5.19 0.071 0.800 0.236 0.429     412.589     400.000       8.106   61 
-    610000      122000.00      43.171      10.238      53.409   6.37 0.143 0.500 0.227 1.275     391.668     390.000       8.689   61 
-    620000      124000.00      41.562       9.774      51.336   5.60 0.071 0.833 0.341 0.248     377.070     390.000       7.871   61 
-    630000      126000.00      44.859      18.433      63.292   7.35 0.000 1.000 0.136 0.841     406.983     390.000      11.889   61 
-    640000      128000.00      39.831       7.621      47.452   7.81 0.071 0.500 0.136 0.491     361.366     390.000      11.163   61 
-    650000      130000.00      40.026       7.839      47.866   5.11 0.071 0.857 0.318 0.295     363.138     390.000       8.140   61 
-    660000      132000.00      41.785       8.561      50.345   6.61 0.000 1.000 0.364 0.447     379.094     390.000       8.972   61 
-    670000      134000.00      39.281      20.792      60.073   8.17 0.071 0.750 0.205 0.326     356.382     390.000      11.501   61 
-    680000      136000.00      39.819      12.032      51.850   5.89 0.071 0.500 0.136 0.462     361.255     390.000      10.529   61 
-    690000      138000.00      38.896      14.668      53.564   7.50 0.143 0.333 0.167 0.460     352.884     390.000      10.890   61 
-    700000      140000.00      41.581      11.614      53.194   5.41 0.071 0.667 0.242 0.413     377.242     390.000       9.804   61 
-    710000      142000.00      42.792       2.423      45.214   7.03 0.071 0.800 0.355 0.830     388.227     380.000       9.364   61 
-    720000      144000.00      26.006      22.773      48.778   6.06 0.071 0.500 0.136 0.443     235.936     380.000       9.811   61 
-    730000      146000.00      37.667       0.292      37.959   4.57 0.071 0.800 0.282 0.472     341.734     380.000       7.716   61 
-    740000      148000.00      38.737      22.766      61.504   8.79 0.000 1.000 0.159 1.109     351.444     380.000      10.999   61 
-    750000      150000.00      37.745       9.409      47.154   6.24 0.143 0.500 0.159 0.117     342.442     380.000      10.782   61 
-    760000      152000.00      42.745       5.114      47.860   6.07 0.143 0.600 0.382 0.562     387.809     380.000       7.963   61 
-    770000      154000.00      40.623       8.374      48.997   5.86 0.000 1.000 0.227 0.917     368.555     380.000       8.423   61 
-    780000      156000.00      43.284      21.667      64.950  10.04 0.000 1.000 0.136 0.288     392.692     380.000      13.780   61 
-    790000      158000.00      32.744      15.016      47.759   6.73 0.071 0.667 0.394 0.616     297.067     380.000       9.042   61 
-    800000      160000.00      34.942      -1.246      33.696   5.67 0.071 0.857 0.279 0.195     317.012     380.000       7.816   61 
-    810000      162000.00      39.311       5.549      44.860   5.26 0.071 0.800 0.364 1.096     356.653     350.000       8.445   61 
-    820000      164000.00      37.495      -0.253      37.242   6.30 0.143 0.333 0.424 0.173     340.177     350.000       7.884   61 
-    830000      166000.00      42.275       5.039      47.314   4.16 0.143 0.818 0.289 0.842     383.538     350.000       7.895   61 
-    840000      168000.00      34.381       3.897      38.279   8.24 0.071 0.800 0.227 0.375     311.925     350.000      10.496   61 
-    850000      170000.00      36.997      -5.390      31.607   3.22 0.286 0.733 0.388 0.386     335.653     350.000       7.121   61 
-    860000      172000.00      34.009      -0.011      33.999   8.09 0.071 0.833 0.220 0.867     308.551     350.000       9.056   61 
-    870000      174000.00      36.465       1.978      38.443   7.03 0.286 0.429 0.195 0.418     330.831     350.000       9.819   61 
-    880000      176000.00      47.138       1.342      48.480   4.47 0.071 0.800 0.309 0.747     427.660     350.000       8.427   61 
-    890000      178000.00      38.041       8.861      46.902   5.12 0.071 0.500 0.182 0.617     345.126     350.000       8.854   61 
-    900000      180000.00      35.658      -1.796      33.862   4.56 0.214 0.571 0.253 0.381     323.511     350.000       7.854   61 
-    910000      182000.00      40.036      -7.948      32.088   5.35 0.071 0.900 0.432 0.388     363.225     350.000       8.367   61 
-    920000      184000.00      31.469       4.602      36.070   6.66 0.000   NaN   NaN 0.906     285.499     350.000      10.054   61 
-    930000      186000.00      29.080       2.791      31.871   9.23 0.143 0.500 0.193 1.040     263.830     350.000      10.826   61 
-    940000      188000.00      32.954      -0.341      32.612   4.54 0.214 0.250 0.170 0.466     298.974     350.000       7.883   61 
-    950000      190000.00      32.921      -2.950      29.971   6.13 0.071 0.875 0.375 0.297     298.678     350.000       7.423   61 
-    960000      192000.00      38.428      -0.426      38.002   5.63 0.071 0.889 0.394 0.264     348.636     350.000       7.419   61 
-    970000      194000.00      25.807       6.442      32.249   9.11 0.143 0.000 0.136 0.396     234.130     350.000      12.318   61 
-    980000      196000.00      27.616      -4.797      22.820   4.67 0.214 0.500 0.197 0.702     250.548     350.000       8.698   61 
-    990000      198000.00      38.369       2.214      40.583   5.07 0.071 0.875 0.278 0.766     348.107     350.000       9.169   61 
-   1000000      200000.00      38.004      17.807      55.810   8.70 0.071 0.500 0.136 0.930     344.788     350.000      12.789   61