Wednesday, September 25 2024 16:19:12
UNRES
6.16s
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CTEST_FULL_OUTPUT JESTEM ishiftca= 1 ilastca= 76 init_dfa_vars finished! ishiftca= 1 ilastca= 76 init_dfa_vars finished! read_dfa_info finished! T 537191936 8 T 537191936 10 T 537191936 11 T 537191936 14 T 537191936 16 T 537191936 19 T 537191936 20 T 537191936 22 T 537191936 23 T 537191936 24 T 537191936 25 T 537191936 26 T 537191936 29 T 537191936 30 T 537191936 31 T 537191936 33 T 537191936 34 T 537191936 36 T 537191936 37 T 537191936 38 T 537191936 39 T 537191936 40 T 537191936 42 T 537191936 43 T 537191936 44 T 537191936 46 T 537191936 47 T 537191936 49 T 537191936 52 T 537191936 53 T 537191936 56 T 537191936 58 T 537191936 60 T 537191936 62 T 537191936 67 T 537191936 68 T 537191936 70 T 537191936 78 T 537191936 79 T 537191936 82 T 537191936 83 T 537191936 84 T 537191936 85 T 537191936 94 T 537191936 95 T 537191936 97 T 537191936 99 T 537191936 100 T 537191936 101 T 537191936 104 T 537191936 106 T 537191936 108 T 537191936 109 T 537191936 110 T 537191936 111 T 537191936 113 T 537191936 114 T 537191936 119 T 537191936 120 T 537191936 121 T 537191936 122 T 537191936 125 T 537191936 127 T 537191936 129 T 537191936 130 T 537191936 132 T 537191936 140 T 537191936 143 T 537191936 147 T 537191936 153 T 537191936 157 T 537191936 159 T 537191936 161 T 537191936 163 T 537191936 1 T 537191936 2 T 537191936 3 T 537191936 4 T 537191936 5 T 537191936 6 T 537191936 9 T 537191936 12 T 537191936 13 T 537191936 15 T 537191936 18 T 537191936 21 T 537191936 28 T 537191936 32 T 537191936 41 T 537191936 48 T 537191936 50 T 537191936 51 T 537191936 57 T 537191936 63 T 537191936 64 T 537191936 66 T 537191936 69 T 537191936 73 T 537191936 74 T 537191936 75 T 537191936 76 T 537191936 77 T 537191936 96 T 537191936 107 T 537191936 112 T 537191936 118 T 537191936 135 T 537191936 149 T 537191936 150 T 537191936 156 T 537191936 45 T 537191936 54 T 537191936 61 T 537191936 81 T 537191936 86 T 537191936 89 T 537191936 90 T 537191936 91 T 537191936 98 T 537191936 105 T 537191936 115 T 537191936 116 T 537191936 117 T 537191936 124 T 537191936 126 T 537191936 128 T 537191936 131 T 537191936 136 T 537191936 137 T 537191936 138 T 537191936 139 T 537191936 141 T 537191936 142 T 537191936 144 T 537191936 145 T 537191936 146 T 537191936 148 T 537191936 151 T 537191936 152 T 537191936 154 T 537191936 155 T 537191936 158 T 537191936 162 T 537191936 165 T 537191936 166 STOP ********** Program terminated normally. STOP ********** Program terminated normally. T 537191936 167 T 537191936 7 T 537191936 17 T 537191936 27 T 537191936 55 T 537191936 59 T 537191936 72 T 537191936 80 T 537191936 87 T 537191936 88 T 537191936 92 T 537191936 93 T 537191936 103 T 537191936 123 T 537191936 133 T 537191936 134 T 537191936 160 T 537191936 35 T 537191936 65 T 537191936 71 T 537191936 102 T 537191936 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
