Wednesday, September 25 2024 02:21:21
UNRES
4.44s
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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 422684736 8 T 422684736 10 T 422684736 11 T 422684736 14 T 422684736 16 T 422684736 19 T 422684736 20 T 422684736 22 T 422684736 23 T 422684736 24 T 422684736 25 T 422684736 26 T 422684736 29 T 422684736 30 T 422684736 31 T 422684736 33 T 422684736 34 T 422684736 36 T 422684736 37 T 422684736 38 T 422684736 39 T 422684736 40 T 422684736 42 T 422684736 43 T 422684736 44 T 422684736 46 T 422684736 47 T 422684736 49 T 422684736 52 T 422684736 53 T 422684736 56 T 422684736 58 T 422684736 60 T 422684736 62 T 422684736 67 T 422684736 68 T 422684736 70 T 422684736 78 T 422684736 79 T 422684736 82 T 422684736 83 T 422684736 84 T 422684736 85 T 422684736 94 T 422684736 95 T 422684736 97 T 422684736 99 T 422684736 100 T 422684736 101 T 422684736 104 T 422684736 106 T 422684736 108 T 422684736 109 T 422684736 110 T 422684736 111 T 422684736 113 T 422684736 114 T 422684736 119 T 422684736 120 T 422684736 121 T 422684736 122 T 422684736 125 T 422684736 127 T 422684736 129 T 422684736 130 T 422684736 132 T 422684736 140 T 422684736 143 T 422684736 147 T 422684736 153 T 422684736 157 T 422684736 159 T 422684736 161 T 422684736 163 T 422684736 1 T 422684736 2 T 422684736 3 T 422684736 4 T 422684736 5 T 422684736 6 T 422684736 9 T 422684736 12 T 422684736 13 T 422684736 15 T 422684736 18 T 422684736 21 T 422684736 28 T 422684736 32 T 422684736 41 T 422684736 48 T 422684736 50 T 422684736 51 T 422684736 57 T 422684736 63 T 422684736 64 T 422684736 66 T 422684736 69 T 422684736 73 T 422684736 74 T 422684736 75 T 422684736 76 T 422684736 77 T 422684736 96 T 422684736 107 T 422684736 112 T 422684736 118 T 422684736 135 T 422684736 149 T 422684736 150 T 422684736 156 T 422684736 45 T 422684736 54 T 422684736 61 T 422684736 81 T 422684736 86 T 422684736 89 T 422684736 90 T 422684736 91 T 422684736 98 T 422684736 105 T 422684736 115 T 422684736 116 T 422684736 117 T 422684736 124 T 422684736 126 T 422684736 128 T 422684736 131 T 422684736 136 T 422684736 137 T 422684736 138 T 422684736 139 T 422684736 141 T 422684736 142 T 422684736 144 T 422684736 145 T 422684736 146 T 422684736 148 T 422684736 151 T 422684736 152 T 422684736 154 T 422684736 155 T 422684736 158 T 422684736 162 T 422684736 165 T 422684736 166 STOP ********** Program terminated normally. STOP ********** Program terminated normally. T 422684736 167 T 422684736 7 T 422684736 17 T 422684736 27 T 422684736 55 T 422684736 59 T 422684736 72 T 422684736 80 T 422684736 87 T 422684736 88 T 422684736 92 T 422684736 93 T 422684736 103 T 422684736 123 T 422684736 133 T 422684736 134 T 422684736 160 T 422684736 35 T 422684736 65 T 422684736 71 T 422684736 102 T 422684736 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
