New examples based on current version of UNRES.
[unres.git] / examples / unres / new / MREMD / ff_1l2y / fort.2
1  Start reading THETA_PDB
2  End reading THETA_PDB
3  acceleration/energy drift too large   8.75469407693134     
4    100.947155014428       split increased to            2  itime      970413 
5   itsplit           1
6  acceleration/energy drift too large   11.9813494885241     
7    151.023155270513       split increased to            2  itime      974224 
8   itsplit           1
9  acceleration/energy drift too large   6.34134188119507     
10    33.8591387762422       split increased to            2  itime      849330 
11   itsplit           1
12  acceleration/energy drift too large   10.4386757972384     
13    197.930632539386       split increased to            2  itime      998141 
14   itsplit           1
15  acceleration/energy drift too large   3.29672929989142     
16    75.2614666762338       split increased to            4  itime      998141 
17   itsplit           2
18  acceleration/energy drift too large   2.36653778137160     
19    144.675440167035       split increased to            8  itime      998141 
20   itsplit           4
21  acceleration/energy drift too large   1.12808537973992     
22    126.840116141663       split increased to           16  itime      998141 
23   itsplit           7
24  acceleration/energy drift too large  0.643283558309138     
25    165.191761588105       split increased to           32  itime      998141 
26   itsplit          13
27  acceleration/energy drift too large   10.3943279509865     
28    60.3414655409778       split increased to            2  itime      951163 
29   itsplit           1
30  acceleration/energy drift too large   3.26318326765345     
31    22.1400423103924       split increased to            4  itime      951163 
32   itsplit           2
33  acceleration/energy drift too large   4.46702446482154     
34    12.9174595938524       split increased to            2  itime      841267 
35   itsplit           1
36  acceleration/energy drift too large   8.71015825849746     
37    45.9740270072640       split increased to            2  itime      853135 
38   itsplit           1
39  acceleration/energy drift too large   5.22578093845543     
40    36.3963033292437       split increased to            2  itime      935778 
41   itsplit           1
42  acceleration/energy drift too large   17.2977275225635     
43    300.448750398714       split increased to            2  itime      968761 
44   itsplit           1
45  acceleration/energy drift too large   6.92954827779004     
46    99.2081768941197       split increased to            2  itime      930381 
47   itsplit           1
48  acceleration/energy drift too large   21.9400879393517     
49    300.553629084162       split increased to            2  itime      944336 
50   itsplit           1
51  acceleration/energy drift too large   2.85510125955739     
52    11.3635262600859       split increased to            2  itime      977572 
53   itsplit           1
54  acceleration/energy drift too large   3.51417377277529     
55    10.8713790550659       split increased to            2  itime      977573 
56   itsplit           1
57  acceleration/energy drift too large   5.10982782323423     
58    16.9370203541357       split increased to            2  itime      911018 
59   itsplit           1
60  acceleration/energy drift too large   17.8509240365023     
61    200.471178398803       split increased to            2  itime      925235 
62   itsplit           1
63  acceleration/energy drift too large   8.91893850848231     
64    51.5063648092223       split increased to            2  itime      961803 
65   itsplit           1
66  acceleration/energy drift too large   4.78009519824987     
67    14.7585639383405       split increased to            2  itime      993826 
68   itsplit           1
69  acceleration/energy drift too large   4.69783633685660     
70    19.9091272165687       split increased to            2  itime      987661 
71   itsplit           1
72  acceleration/energy drift too large   4.07146496621216     
73    10.8616089705807       split increased to            2  itime      982655 
74   itsplit           1
75  acceleration/energy drift too large   3.49986118817264     
76    24.2524197529414       split increased to            2  itime      976295 
77   itsplit           1
78  acceleration/energy drift too large   9.62427395120321     
79    602.413168794923       split increased to            4  itime      976295 
80   itsplit           1
81  acceleration/energy drift too large   1.20185405427270     
82    37.6142270255815       split increased to            8  itime      976295 
83   itsplit           1
84  acceleration/energy drift too large   3.66139523296962     
85    18.8311473470532       split increased to            2  itime      981840 
86   itsplit           1
87  acceleration/energy drift too large   5.63185918335395     
88    157.601376597025       split increased to            4  itime      688199 
89   itsplit           1
90  acceleration/energy drift too large   1.19767870166086     
91    30.2336531567217       split increased to            8  itime      688199 
92   itsplit           1
93  acceleration/energy drift too large   7.13125651258700     
94    17.4197684174688       split increased to            2  itime      708828 
95   itsplit           1
96  acceleration/energy drift too large   6.67624630468350     
97    60.0565026510500       split increased to            2  itime      818987 
98   itsplit           1
99  acceleration/energy drift too large   2.07847064010115     
100    21.6817010181585       split increased to            4  itime      818987 
101   itsplit           2
102  acceleration/energy drift too large   4.61985170896771     
103    11.7915987073102       split increased to            2  itime      835065 
104   itsplit           1
105  acceleration/energy drift too large   7.26178113403994     
106    33.7065992004155       split increased to            2  itime      934007 
107   itsplit           1
108  acceleration/energy drift too large   4.97149663568859     
109    26.0825181221898       split increased to            2  itime      973247 
110   itsplit           1
111  acceleration/energy drift too large   7.32517334595591     
112    29.3609714595789       split increased to            2  itime      986402 
113   itsplit           1