Tuesday, September 24 2024 08:23:50
UNRES
6.21s
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CTEST_FULL_OUTPUT JESTEM ishiftca= 1 ilastca= 76 init_dfa_vars finished! read_dfa_info finished! ishiftca= 1 ilastca= 76 init_dfa_vars finished! read_dfa_info finished! T 1270058352 8 T 1270058352 10 T 1270058352 11 T 1270058352 14 T 1270058352 16 T 1270058352 19 T 1270058352 20 T 1270058352 22 T 1270058352 23 T 1270058352 24 T 1270058352 25 T 1270058352 26 T 1270058352 29 T 1270058352 30 T 1270058352 31 T 1270058352 33 T 1270058352 34 T 1270058352 36 T 1270058352 37 T 1270058352 38 T 1270058352 39 T 1270058352 40 T 1270058352 42 T 1270058352 43 T 1270058352 44 T 1270058352 46 T 1270058352 47 T 1270058352 49 T 1270058352 52 T 1270058352 53 T 1270058352 56 T 1270058352 58 T 1270058352 60 T 1270058352 62 T 1270058352 67 T 1270058352 68 T 1270058352 70 T 1270058352 78 T 1270058352 79 T 1270058352 82 T 1270058352 83 T 1270058352 84 T 1270058352 85 T 1270058352 94 T 1270058352 95 T 1270058352 97 T 1270058352 99 T 1270058352 100 T 1270058352 101 T 1270058352 104 T 1270058352 106 T 1270058352 108 T 1270058352 109 T 1270058352 110 T 1270058352 111 T 1270058352 113 T 1270058352 114 T 1270058352 119 T 1270058352 120 T 1270058352 121 T 1270058352 122 T 1270058352 125 T 1270058352 127 T 1270058352 129 T 1270058352 130 T 1270058352 132 T 1270058352 140 T 1270058352 143 T 1270058352 147 T 1270058352 153 T 1270058352 157 T 1270058352 159 T 1270058352 161 T 1270058352 163 T 1270058352 1 T 1270058352 2 T 1270058352 3 T 1270058352 4 T 1270058352 5 T 1270058352 6 T 1270058352 9 T 1270058352 12 T 1270058352 13 T 1270058352 15 T 1270058352 18 T 1270058352 21 T 1270058352 28 T 1270058352 32 T 1270058352 41 T 1270058352 48 T 1270058352 50 T 1270058352 51 T 1270058352 57 T 1270058352 63 T 1270058352 64 T 1270058352 66 T 1270058352 69 T 1270058352 73 T 1270058352 74 T 1270058352 75 T 1270058352 76 T 1270058352 77 T 1270058352 96 T 1270058352 107 T 1270058352 112 T 1270058352 118 T 1270058352 135 T 1270058352 149 T 1270058352 150 T 1270058352 156 T 1270058352 45 T 1270058352 54 T 1270058352 61 T 1270058352 81 T 1270058352 86 T 1270058352 89 T 1270058352 90 T 1270058352 91 T 1270058352 98 T 1270058352 105 T 1270058352 115 T 1270058352 116 T 1270058352 117 T 1270058352 124 T 1270058352 126 T 1270058352 128 T 1270058352 131 T 1270058352 136 T 1270058352 137 T 1270058352 138 T 1270058352 139 T 1270058352 141 T 1270058352 142 T 1270058352 144 T 1270058352 145 T 1270058352 146 T 1270058352 148 T 1270058352 151 T 1270058352 152 T 1270058352 154 T 1270058352 155 T 1270058352 158 T 1270058352 162 T 1270058352 165 STOP ********** Program terminated normally. STOP ********** Program terminated normally. T 1270058352 166 T 1270058352 167 T 1270058352 7 T 1270058352 17 T 1270058352 27 T 1270058352 55 T 1270058352 59 T 1270058352 72 T 1270058352 80 T 1270058352 87 T 1270058352 88 T 1270058352 92 T 1270058352 93 T 1270058352 103 T 1270058352 123 T 1270058352 133 T 1270058352 134 T 1270058352 160 T 1270058352 35 T 1270058352 65 T 1270058352 71 T 1270058352 102 T 1270058352 164 THERE ARE 5 FAMILIES OF CONFORMATIONS dfa_wham_T280K_0001.pdb:REMARK CLUSTER 1 FREE ENERGY -8.97822E+02 AVE RMSD 0.00 dfa_wham_T280K_0001.pdb:REMARK clustering ENERGY -8.95672E+02 RMS 0.00 dfa_wham_T280K_0002.pdb:REMARK CLUSTER 2 FREE ENERGY -8.97513E+02 AVE RMSD 0.00 dfa_wham_T280K_0002.pdb:REMARK clustering ENERGY -8.95717E+02 RMS 0.00 dfa_wham_T280K_0003.pdb:REMARK CLUSTER 3 FREE ENERGY -8.97022E+02 AVE RMSD 0.00 dfa_wham_T280K_0003.pdb:REMARK clustering ENERGY -8.95605E+02 RMS 0.00 dfa_wham_T280K_0004.pdb:REMARK CLUSTER 4 FREE ENERGY -8.96936E+02 AVE RMSD 0.00 dfa_wham_T280K_0004.pdb:REMARK clustering ENERGY -8.95673E+02 RMS 0.00 dfa_wham_T280K_0005.pdb:REMARK CLUSTER 5 FREE ENERGY -8.96287E+02 AVE RMSD 0.00 dfa_wham_T280K_0005.pdb:REMARK clustering ENERGY -8.95636E+02 RMS 0.00
