Merge branch 'prerelease-3.2.1' into czarek

[unres.git] / examples / unres / MREMD / ff_gab / outputs / 1L2Y_MREMD_GB019.stat

diff --git a/examples/unres/MREMD/ff_gab/outputs/1L2Y_MREMD_GB019.stat b/examples/unres/MREMD/ff_gab/outputs/1L2Y_MREMD_GB019.stat
new file mode 100644 (file)
index 0000000..037d577
--- /dev/null
+++ b/examples/unres/MREMD/ff_gab/outputs/1L2Y_MREMD_GB019.stat
@@ -0,0 +1,101 @@
+         0           0.00      41.827      24.626      66.453  12.87 0.000   NaN   NaN 0.706     379.473     340.000      15.552   19 
+     10000        2000.00      25.965      26.550      52.515   7.84 0.000   NaN   NaN 2.024     235.571     340.000      10.243   19 
+     20000        4000.00      33.643      -0.031      33.612   7.07 0.143 0.333 0.167 2.921     305.228     340.000       9.686   19 
+     30000        6000.00      36.005      -6.133      29.872   5.32 0.000 1.000 0.136 2.535     326.654     340.000       8.340   19 
+     40000        8000.00      32.197       0.991      33.188   5.14 0.000 1.000 0.288 1.173     292.106     340.000       8.830   19 
+     50000       10000.00      42.937      -8.975      33.962   6.07 0.143 0.600 0.418 1.663     389.547     340.000       7.483   19 
+     60000       12000.00      26.235       2.890      29.125   5.96 0.071 0.500 0.159 1.679     238.017     340.000      10.034   19 
+     70000       14000.00      32.652      -8.135      24.517   3.58 0.286 0.600 0.323 1.327     296.232     340.000       7.352   19 
+     80000       16000.00      35.242     -24.783      10.459   4.01 0.143 0.500 0.352 1.254     319.731     340.000       8.171   19 
+     90000       18000.00      41.211      -2.214      38.997   4.29 0.000 1.000 0.182 1.737     373.886     340.000       9.271   19 
+    100000       20000.00      32.175     -17.266      14.909   4.12 0.214 0.750 0.284 1.270     291.909     340.000       7.114   19 
+    110000       22000.00      32.453      -5.201      27.253  12.50 0.000   NaN   NaN 1.500     294.433     330.000      16.436   19 
+    120000       24000.00      31.117     -10.551      20.566   4.53 0.071 0.833 0.303 0.898     282.313     330.000       6.968   19 
+    130000       26000.00      34.896     -25.860       9.036   3.71 0.143 0.750 0.227 1.782     316.597     330.000       7.629   19 
+    140000       28000.00      20.091     -23.083      -2.992   3.95 0.143 0.714 0.377 3.046     182.274     330.000       7.175   19 
+    150000       30000.00      33.948     -17.766      16.182   6.70 0.286 0.429 0.208 2.137     307.993     330.000       9.276   19 
+    160000       32000.00      30.084     -18.305      11.779   4.93 0.071 0.889 0.273 0.995     272.938     330.000       7.662   19 
+    170000       34000.00      47.085      -1.547      45.537   7.70 0.071 0.750 0.170 1.910     427.177     330.000       9.675   19 
+    180000       36000.00      49.815      -2.320      47.495   7.13 0.000 1.000 0.182 4.772     451.948     330.000      11.593   19 
+    190000       38000.00      30.270     -26.889       3.380   5.48 0.143 0.667 0.311 1.153     274.624     330.000       7.904   19 
+    200000       40000.00      39.949      -5.588      34.362   7.28 0.000 1.000 0.318 1.593     362.442     330.000       7.851   19 
+    210000       42000.00      29.160     -18.048      11.112   4.62 0.143 0.333 0.273 1.431     264.555     360.000       8.882   19 
+    220000       44000.00      39.554     -11.263      28.291   5.46 0.071 0.800 0.236 1.859     358.851     360.000       7.686   19 
+    230000       46000.00      35.720       5.224      40.944   5.40 0.000 1.000 0.398 1.189     324.069     360.000       7.674   19 
+    240000       48000.00      32.346       5.018      37.364   9.20 0.071 0.000 0.182 0.977     293.456     360.000      12.028   19 
+    250000       50000.00      33.159       5.888      39.047   5.18 0.214 0.500 0.341 1.564     300.835     360.000       8.490   19 
+    260000       52000.00      45.540       7.822      53.362   4.59 0.071 0.000 0.136 2.475     413.162     360.000       9.634   19 
+    270000       54000.00      32.450      -1.715      30.736   6.80 0.071 0.750 0.205 2.624     294.408     360.000      10.687   19 
+    280000       56000.00      42.416      -7.001      35.415   7.54 0.071 0.800 0.355 2.082     384.822     360.000      10.154   19 
+    290000       58000.00      44.390       1.332      45.722   5.26 0.071 0.833 0.227 1.633     402.729     360.000       7.656   19 
+    300000       60000.00      39.743      -5.785      33.958   4.98 0.143 0.600 0.518 2.006     360.572     360.000       7.117   19 
+    310000       62000.00      45.701     -10.522      35.179   5.81 0.143 0.500 0.398 1.160     414.624     340.000       8.456   19 
+    320000       64000.00      25.984      -4.745      21.239   4.76 0.000 1.000 0.500 2.079     235.736     340.000       8.717   19 
+    330000       66000.00      27.360     -15.602      11.758   6.13 0.071 0.900 0.300 1.589     248.227     340.000       8.049   19 
+    340000       68000.00      32.183      -6.031      26.152  10.37 0.071 0.000 0.182 1.445     291.981     340.000      13.293   19 
+    350000       70000.00      31.673      -7.448      24.225  10.17 0.071 0.000 0.182 1.933     287.357     340.000      12.960   19 
+    360000       72000.00      40.735      -1.326      39.409   6.22 0.000   NaN   NaN 1.341     369.569     340.000      10.617   19 
+    370000       74000.00      32.473       6.742      39.215   6.87 0.071 0.500 0.250 1.279     294.611     340.000       9.749   19 
+    380000       76000.00      47.748      -4.236      43.511   7.43 0.000 1.000 0.227 4.430     433.190     340.000       9.065   19 
+    390000       78000.00      33.122      -7.031      26.091   4.63 0.071 0.500 0.409 0.880     300.500     340.000       8.964   19 
+    400000       80000.00      28.344     -13.578      14.766   7.57 0.071 0.800 0.200 1.185     257.152     340.000      10.152   19 
+    410000       82000.00      43.206      -1.105      42.101   4.83 0.071 0.000 0.136 1.348     391.991     330.000       8.949   19 
+    420000       84000.00      36.597      -6.654      29.943   5.75 0.000 1.000 0.455 3.130     332.030     330.000       9.071   19 
+    430000       86000.00      30.489      -9.596      20.893   5.44 0.071 0.833 0.644 1.638     276.612     330.000       8.455   19 
+    440000       88000.00      33.540     -10.283      23.257   3.85 0.143 0.600 0.491 1.668     304.292     330.000       7.986   19 
+    450000       90000.00      29.225       4.806      34.032   6.26 0.000 1.000 0.443 2.060     265.148     330.000       7.853   19 
+    460000       92000.00      35.043     -10.133      24.909   4.69 0.143 0.778 0.258 2.386     317.925     330.000       7.940   19 
+    470000       94000.00      33.416     -17.055      16.361   6.71 0.143 0.333 0.152 2.186     303.168     330.000      11.151   19 
+    480000       96000.00      35.426     -13.205      22.221   6.92 0.000 1.000 0.227 1.401     321.402     330.000       9.496   19 
+    490000       98000.00      31.845     -12.314      19.531   6.18 0.071 0.500 0.227 1.507     288.914     330.000      10.217   19 
+    500000      100000.00      33.202     -19.757      13.445   4.96 0.214 0.625 0.205 1.075     301.228     330.000       8.548   19 
+    510000      102000.00      35.574      -6.247      29.326   9.29 0.071 0.000 0.136 1.038     322.744     370.000      12.760   19 
+    520000      104000.00      34.674       9.898      44.572   8.87 0.000 1.000 0.273 2.527     314.579     370.000      10.992   19 
+    530000      106000.00      40.554      -3.325      37.228   5.14 0.000 1.000 0.318 2.037     367.926     370.000       8.101   19 
+    540000      108000.00      35.391      -2.433      32.958   6.31 0.071 0.500 0.182 2.330     321.084     370.000      10.265   19 
+    550000      110000.00      35.863      -3.154      32.709   4.71 0.143 0.000 0.341 2.628     325.369     370.000       8.421   19 
+    560000      112000.00      27.645      -6.391      21.253   7.57 0.071 0.000 0.136 0.686     250.807     370.000      11.845   19 
+    570000      114000.00      37.348      -0.630      36.718   6.52 0.143 0.500 0.307 2.469     338.838     370.000       9.022   19 
+    580000      116000.00      32.731       3.116      35.846   4.33 0.071 0.750 0.386 1.126     296.951     370.000       7.736   19 
+    590000      118000.00      40.934      -8.918      32.016   4.96 0.071 0.833 0.379 1.638     371.371     370.000       7.359   19 
+    600000      120000.00      40.582     -18.930      21.652   4.27 0.286 0.500 0.386 1.424     368.180     370.000       7.080   19 
+    610000      122000.00      38.268     -10.460      27.808   6.28 0.000   NaN   NaN 1.124     347.188     350.000      11.107   19 
+    620000      124000.00      33.088      -7.114      25.973   6.88 0.071 0.667 0.197 2.244     300.187     350.000       9.563   19 
+    630000      126000.00      30.694      -2.141      28.553   5.49 0.000 1.000 0.273 1.165     278.476     350.000       9.411   19 
+    640000      128000.00      27.779     -13.570      14.208   4.08 0.000 1.000 0.386 1.497     252.021     350.000       7.446   19 
+    650000      130000.00      27.603     -17.003      10.600   5.29 0.143 0.667 0.500 1.670     250.425     350.000       8.730   19 
+    660000      132000.00      34.748      -8.152      26.596   7.70 0.000 1.000 0.355 1.267     315.251     350.000       9.463   19 
+    670000      134000.00      37.393     -12.426      24.967   5.06 0.143 0.500 0.352 1.346     339.252     350.000       8.843   19 
+    680000      136000.00      34.478       4.431      38.909   5.81 0.000 1.000 0.242 2.347     312.801     350.000       8.110   19 
+    690000      138000.00      36.038      -4.852      31.187   6.31 0.143 0.333 0.182 1.990     326.958     350.000       9.837   19 
+    700000      140000.00      36.122      -3.990      32.133   6.42 0.000 1.000 0.375 1.028     327.720     350.000       8.199   19 
+    710000      142000.00      37.153     -18.548      18.605   5.09 0.143 0.600 0.336 1.075     337.067     340.000       8.953   19 
+    720000      144000.00      38.069     -13.722      24.347   5.26 0.143 0.667 0.409 1.660     345.385     340.000       8.125   19 
+    730000      146000.00      29.513     -19.466      10.047   5.46 0.071 0.857 0.331 1.663     267.760     340.000       7.409   19 
+    740000      148000.00      30.321     -19.349      10.971   5.53 0.214 0.400 0.436 2.187     275.086     340.000       8.253   19 
+    750000      150000.00      30.953      -7.272      23.681   9.87 0.071 0.667 0.182 0.968     280.821     340.000      13.812   19 
+    760000      152000.00      34.405      -3.108      31.297   5.57 0.000 1.000 0.727 2.013     312.140     340.000       9.164   19 
+    770000      154000.00      36.473       1.705      38.178   4.55 0.143 0.500 0.455 1.743     330.899     340.000       8.332   19 
+    780000      156000.00      39.047     -11.222      27.825   8.11 0.143 0.333 0.136 1.368     354.253     340.000       9.709   19 
+    790000      158000.00      32.873      -8.660      24.214   5.65 0.214 0.571 0.169 1.670     298.244     340.000       8.947   19 
+    800000      160000.00      28.306      -9.017      19.289   6.18 0.000 1.000 0.442 1.619     256.808     340.000       7.688   19 
+    810000      162000.00      27.707      -6.070      21.637   7.07 0.071 0.000 0.136 0.622     251.368     340.000      10.392   19 
+    820000      164000.00      31.788      -5.819      25.970   8.26 0.000   NaN   NaN 1.574     288.400     340.000      12.549   19 
+    830000      166000.00      27.899      -3.509      24.390   7.95 0.000 1.000 0.227 2.323     253.112     340.000      10.371   19 
+    840000      168000.00      34.277      -9.632      24.645  10.09 0.071 0.750 0.159 1.130     310.975     340.000      12.354   19 
+    850000      170000.00      31.640       5.796      37.436   6.32 0.000 1.000 0.136 3.031     287.055     340.000       9.495   19 
+    860000      172000.00      28.853       4.578      33.430   6.60 0.000 1.000 0.258 2.110     261.768     340.000      10.837   19 
+    870000      174000.00      38.140      -2.822      35.319  10.34 0.000   NaN   NaN 1.972     346.028     340.000      14.194   19 
+    880000      176000.00      42.795      -7.111      35.684   5.44 0.071 0.857 0.325 1.404     388.260     340.000       7.936   19 
+    890000      178000.00      38.278     -19.827      18.450   5.71 0.214 0.625 0.449 1.728     347.274     340.000       6.816   19 
+    900000      180000.00      37.354     -11.361      25.993   5.63 0.000 1.000 0.432 1.624     338.899     340.000       8.876   19 
+    910000      182000.00      33.237     -21.561      11.676   5.96 0.000 1.000 0.473 2.002     301.545     330.000       7.796   19 
+    920000      184000.00      26.140     -10.733      15.408   4.89 0.143 0.667 0.394 3.831     237.160     330.000       9.207   19 
+    930000      186000.00      34.714     -13.431      21.284   5.62 0.143 0.500 0.170 2.319     314.946     330.000      10.022   19 
+    940000      188000.00      31.164     -18.930      12.235   4.73 0.143 0.778 0.369 1.386     282.738     330.000       7.480   19 
+    950000      190000.00      35.410      -9.885      25.525   6.67 0.143 0.333 0.152 1.336     321.256     330.000      10.825   19 
+    960000      192000.00      30.439      -3.595      26.844   7.29 0.000   NaN   NaN 2.624     276.160     330.000      11.588   19 
+    970000      194000.00      36.696      -8.105      28.592   5.92 0.000 1.000 0.432 2.750     332.929     330.000       9.689   19 
+    980000      196000.00      33.419     -13.706      19.714   6.41 0.143 0.714 0.214 1.564     303.197     330.000      10.657   19 
+    990000      198000.00      32.080     -19.507      12.573   7.81 0.143 0.333 0.152 2.218     291.047     330.000       9.979   19 
+   1000000      200000.00      32.603      -4.691      27.912   7.11 0.071 0.800 0.255 2.071     295.789     330.000       9.655   19