Merge branch 'prerelease-3.2.1' into czarek

[unres.git] / examples / unres / new / microcanonical / RESPA / ff_1l2y / 1L2Y_micro_GB004.stat

diff --git a/examples/unres/new/microcanonical/RESPA/ff_1l2y/1L2Y_micro_GB004.stat b/examples/unres/new/microcanonical/RESPA/ff_1l2y/1L2Y_micro_GB004.stat
deleted file mode 100644 (file)
index 5192907..0000000
--- a/examples/unres/new/microcanonical/RESPA/ff_1l2y/1L2Y_micro_GB004.stat
+++ /dev/null
@@ -1,101 +0,0 @@
-         0           0.00      27.886      63.862      91.748   0.00 1.000 0.000 0.308 1.972     252.992     300.000       7.001    4 
-     10000         100.00      68.692      23.050      91.742   3.76 0.286 0.200 0.173 0.045     623.212     300.000       8.671    4 
-     20000         200.00      71.791      19.951      91.742   7.43 0.143 0.600 0.145 0.023     651.325     300.000      10.776    4 
-     30000         300.00      67.403      24.339      91.742   8.08 0.071 0.500 0.182 0.037     611.515     300.000      11.482    4 
-     40000         400.00      67.240      24.502      91.742   8.44 0.071 0.667 0.152 0.042     610.036     300.000      10.710    4 
-     50000         500.00      66.017      25.725      91.742   8.29 0.071 0.500 0.273 0.029     598.943     300.000      10.344    4 
-     60000         600.00      72.191      19.550      91.741   7.55 0.000 1.000 0.250 0.042     654.957     300.000       9.748    4 
-     70000         700.00      63.235      28.507      91.742   8.67 0.000 1.000 0.167 0.030     573.699     300.000      11.349    4 
-     80000         800.00      60.823      30.917      91.740  10.69 0.000 1.000 0.136 0.028     551.818     300.000      13.684    4 
-     90000         900.00      61.891      29.850      91.741  10.27 0.000   NaN   NaN 0.036     561.511     300.000      13.265    4 
-    100000        1000.00      67.672      24.068      91.740   7.49 0.071 0.750 0.216 0.058     613.956     300.000       9.230    4 
-    110000        1100.00      65.683      26.059      91.742   7.01 0.071 0.800 0.182 0.015     595.912     300.000       8.452    4 
-    120000        1200.00      68.879      22.863      91.742   6.38 0.071 0.750 0.205 0.011     624.907     300.000       9.932    4 
-    130000        1300.00      62.690      29.052      91.742   5.61 0.143 0.750 0.267 0.062     568.757     300.000       8.494    4 
-    140000        1400.00      53.533      38.208      91.742   6.70 0.000 1.000 0.250 0.024     485.683     300.000       9.716    4 
-    150000        1500.00      82.449       9.292      91.741   6.70 0.143 0.000 0.159 0.021     748.020     300.000       9.953    4 
-    160000        1600.00      56.444      35.298      91.742   6.70 0.071 0.000 0.136 0.034     512.088     300.000      10.943    4 
-    170000        1700.00      60.660      31.082      91.742   6.05 0.286 0.556 0.202 0.052     550.340     300.000       9.148    4 
-    180000        1800.00      50.587      41.155      91.742   8.87 0.000 1.000 0.182 0.054     458.952     300.000      12.579    4 
-    190000        1900.00      72.057      19.685      91.742   9.26 0.000 1.000 0.205 0.023     653.740     300.000      10.914    4 
-    200000        2000.00      72.019      20.319      92.338   5.92 0.071 0.750 0.193 0.014     653.397     300.000       8.436    4 
-    210000        2100.00      68.633      23.706      92.339   6.52 0.143 0.500 0.159 0.026     622.671     300.000       9.192    4 
-    220000        2200.00      63.122      29.216      92.338   8.84 0.071 0.500 0.159 0.050     572.674     300.000      10.501    4 
-    230000        2300.00      71.746      20.592      92.339   9.71 0.071 0.750 0.182 0.012     650.918     300.000      12.390    4 
-    240000        2400.00      69.995      22.344      92.339   8.22 0.143 0.778 0.157 0.081     635.028     300.000       9.937    4 
-    250000        2500.00      63.264      29.075      92.339   6.42 0.000 1.000 0.182 0.026     573.965     300.000       8.318    4 
-    260000        2600.00      55.883      36.456      92.340   4.67 0.214 0.500 0.167 0.028     507.003     300.000       8.248    4 
-    270000        2700.00      56.021      36.320      92.341   5.40 0.143 0.750 0.250 0.027     508.252     300.000       8.052    4 
-    280000        2800.00      66.423      25.915      92.339   5.47 0.143 0.667 0.288 0.053     602.628     300.000       7.688    4 
-    290000        2900.00      69.211      23.128      92.339   5.45 0.071 0.833 0.364 0.023     627.920     300.000       7.436    4 
-    300000        3000.00      54.265      38.075      92.339   7.12 0.000 1.000 0.318 0.013     492.318     300.000       8.680    4 
-    310000        3100.00      65.315      27.024      92.339   6.28 0.143 0.667 0.235 0.057     592.570     300.000       9.264    4 
-    320000        3200.00      62.376      29.963      92.339   4.71 0.071 0.800 0.664 0.023     565.907     300.000       8.279    4 
-    330000        3300.00      60.242      32.097      92.339   5.33 0.143 0.667 0.220 0.091     546.543     300.000       9.627    4 
-    340000        3400.00      76.538      15.800      92.338   6.93 0.214 0.571 0.162 0.028     694.390     300.000      10.075    4 
-    350000        3500.00      80.727      11.611      92.337   8.18 0.143 0.714 0.201 0.018     732.395     300.000       9.517    4 
-    360000        3600.00      81.062      11.275      92.338   5.88 0.286 0.500 0.176 0.075     735.438     300.000       9.190    4 
-    370000        3700.00      75.552      16.787      92.339   4.25 0.143 0.600 0.236 0.025     685.448     300.000       7.739    4 
-    380000        3800.00      69.084      23.254      92.338   5.58 0.286 0.500 0.290 0.040     626.765     300.000       6.917    4 
-    390000        3900.00      77.176      15.163      92.339   7.43 0.071 0.800 0.173 0.073     700.177     300.000       9.080    4 
-    400000        4000.00      62.076      30.263      92.339   8.52 0.143 0.500 0.170 0.037     563.184     300.000      11.405    4 
-    410000        4100.00      64.608      27.731      92.339   8.33 0.143 0.500 0.148 0.018     586.154     300.000      11.965    4 
-    420000        4200.00      69.968      22.371      92.339   6.39 0.214 0.500 0.220 0.026     634.787     300.000      10.257    4 
-    430000        4300.00      59.747      32.592      92.339   5.21 0.143 0.333 0.182 0.019     542.055     300.000       8.444    4 
-    440000        4400.00      64.935      27.405      92.340   6.06 0.000 1.000 0.136 0.013     589.124     300.000      10.802    4 
-    450000        4500.00      69.991      22.348      92.339   7.17 0.000 1.000 0.136 0.010     634.993     300.000      11.787    4 
-    460000        4600.00      63.619      28.720      92.339   6.81 0.143 0.500 0.170 0.040     577.185     300.000      11.137    4 
-    470000        4700.00      63.911      28.428      92.339   6.33 0.071 0.667 0.152 0.024     579.835     300.000      10.425    4 
-    480000        4800.00      60.674      31.666      92.339   7.47 0.071 0.000 0.136 0.016     550.462     300.000      11.666    4 
-    490000        4900.00      66.611      25.727      92.338   7.45 0.071 0.000 0.136 0.021     604.331     300.000      11.523    4 
-    500000        5000.00      63.120      29.218      92.338   9.64 0.000   NaN   NaN 0.068     572.662     300.000      13.092    4 
-    510000        5100.00      59.101      33.238      92.339   8.12 0.214 0.000 0.152 0.065     536.193     300.000      11.669    4 
-    520000        5200.00      53.734      38.606      92.340   4.84 0.143 0.500 0.148 0.020     487.501     300.000       7.571    4 
-    530000        5300.00      61.325      31.014      92.339   5.09 0.071 0.667 0.379 0.021     556.371     300.000       8.435    4 
-    540000        5400.00      77.176      15.164      92.340   3.96 0.143 0.667 0.394 0.014     700.178     300.000       7.730    4 
-    550000        5500.00      64.630      27.710      92.339   7.00 0.000 1.000 0.205 0.033     586.355     300.000       9.648    4 
-    560000        5600.00      74.832      17.507      92.339   7.72 0.214 0.667 0.202 0.046     678.914     300.000       9.315    4 
-    570000        5700.00      66.172      26.167      92.339   6.91 0.071 0.000 0.136 0.020     600.343     300.000      10.433    4 
-    580000        5800.00      68.254      24.085      92.340  10.57 0.071 0.500 0.159 0.067     619.239     300.000      13.689    4 
-    590000        5900.00      65.169      27.170      92.339  10.03 0.143 0.500 0.136 0.045     591.242     300.000      13.852    4 
-    600000        6000.00      74.703      17.636      92.339   6.02 0.000 1.000 0.255 0.048     677.747     300.000       9.596    4 
-    610000        6100.00      68.596      23.743      92.339   6.44 0.000 1.000 0.182 0.018     622.336     300.000       9.907    4 
-    620000        6200.00      64.687      27.652      92.340   7.76 0.071 0.500 0.159 0.015     586.876     300.000      11.983    4 
-    630000        6300.00      59.500      32.839      92.339   8.74 0.000 1.000 0.159 0.081     539.814     300.000      12.748    4 
-    640000        6400.00      72.375      19.964      92.339   7.72 0.071 0.667 0.152 0.045     656.625     300.000      11.203    4 
-    650000        6500.00      70.312      22.026      92.338   8.52 0.071 0.500 0.136 0.054     637.902     300.000      12.149    4 
-    660000        6600.00      64.811      27.527      92.338  10.22 0.000 1.000 0.136 0.037     588.003     300.000      13.577    4 
-    670000        6700.00      69.200      23.137      92.337   9.41 0.143 0.000 0.159 0.068     627.820     300.000      13.240    4 
-    680000        6800.00      70.429      21.910      92.339   4.65 0.143 0.500 0.159 0.016     638.971     300.000       8.790    4 
-    690000        6900.00      66.295      26.045      92.339   5.64 0.214 0.400 0.164 0.031     601.460     300.000       9.739    4 
-    700000        7000.00      63.975      28.364      92.339   9.49 0.000   NaN   NaN 0.029     580.410     300.000      12.802    4 
-    710000        7100.00      62.561      29.777      92.339   9.27 0.000   NaN   NaN 0.023     567.588     300.000      12.955    4 
-    720000        7200.00      62.847      29.492      92.339   7.05 0.000 1.000 0.212 0.037     570.177     300.000      10.946    4 
-    730000        7300.00      66.953      25.385      92.338   6.87 0.071 0.500 0.136 0.032     607.434     300.000      10.110    4 
-    740000        7400.00      66.451      25.888      92.339   5.74 0.000 1.000 0.273 0.014     602.881     300.000       8.915    4 
-    750000        7500.00      63.005      29.334      92.339   5.82 0.143 0.600 0.300 0.037     571.614     300.000       7.292    4 
-    760000        7600.00      62.464      29.875      92.339   6.69 0.286 0.500 0.438 0.030     566.705     300.000       7.016    4 
-    770000        7700.00      67.722      24.616      92.338   5.11 0.143 0.750 0.324 0.034     614.406     300.000       7.073    4 
-    780000        7800.00      70.389      29.258      99.647   5.09 0.214 0.667 0.268 0.052     638.604     300.000       7.854    4 
-    790000        7900.00      68.960      30.687      99.647   5.61 0.000 1.000 0.148 0.026     625.640     300.000      10.367    4 
-    800000        8000.00      71.751      27.894      99.646   5.55 0.071 0.800 0.227 0.032     650.966     300.000       9.123    4 
-    810000        8100.00      76.831      22.830      99.660   5.16 0.000 1.000 0.239 0.115     697.046     300.000       8.900    4 
-    820000        8200.00      68.551      31.110      99.661   5.45 0.000 1.000 0.182 0.049     621.926     300.000       9.186    4 
-    830000        8300.00      68.934      30.728      99.661   6.89 0.000 1.000 0.197 0.035     625.403     300.000       9.487    4 
-    840000        8400.00      75.717      23.945      99.662   6.05 0.000 1.000 0.182 0.022     686.947     300.000       8.820    4 
-    850000        8500.00      80.691      18.969      99.660   6.41 0.000 1.000 0.205 0.023     732.070     300.000       9.635    4 
-    860000        8600.00      65.917      33.745      99.662   7.01 0.071 0.667 0.167 0.042     598.031     300.000      10.915    4 
-    870000        8700.00      80.322      19.339      99.662   6.89 0.143 0.500 0.170 0.047     728.727     300.000       9.510    4 
-    880000        8800.00      65.465      34.196      99.661   7.30 0.071 0.800 0.245 0.081     593.929     300.000       8.486    4 
-    890000        8900.00      58.423      41.237      99.660   7.20 0.000 1.000 0.182 0.035     530.045     300.000       9.365    4 
-    900000        9000.00      70.112      29.550      99.662   6.19 0.000 1.000 0.159 0.021     636.090     300.000      10.316    4 
-    910000        9100.00      70.711      28.950      99.661   9.28 0.071 0.667 0.227 0.078     641.525     300.000      10.982    4 
-    920000        9200.00      81.601      18.059      99.661   7.61 0.071 0.000 0.136 0.030     740.330     300.000      12.070    4 
-    930000        9300.00      57.425      42.237      99.662   4.20 0.071 0.750 0.216 0.024     520.993     300.000       8.782    4 
-    940000        9400.00      71.596      28.065      99.661   4.23 0.071 0.833 0.333 0.052     649.558     300.000       8.000    4 
-    950000        9500.00      64.051      35.609      99.660   4.15 0.000 1.000 0.379 0.017     581.102     300.000       9.178    4 
-    960000        9600.00      70.724      28.936      99.660   5.02 0.143 0.667 0.182 0.027     641.644     300.000       8.655    4 
-    970000        9700.00      67.910      31.751      99.662   6.61 0.000 1.000 0.182 0.047     616.117     300.000      10.479    4 
-    980000        9800.00      74.832      24.828      99.660   6.49 0.071 0.667 0.197 0.041     678.911     300.000       9.807    4 
-    990000        9900.00      73.922      25.739      99.661   7.06 0.071 0.667 0.288 0.036     670.657     300.000       9.596    4 
-   1000000       10000.00      68.913      30.747      99.661   5.83 0.214 0.250 0.159 0.028     625.218     300.000       8.963    4