Sunday, September 22 2024 14:35:54
UNRES
5.83s
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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 2080014368 8 T 2080014368 10 T 2080014368 11 T 2080014368 14 T 2080014368 16 T 2080014368 19 T 2080014368 20 T 2080014368 22 T 2080014368 23 T 2080014368 24 T 2080014368 25 T 2080014368 26 T 2080014368 29 T 2080014368 30 T 2080014368 31 T 2080014368 33 T 2080014368 34 T 2080014368 36 T 2080014368 37 T 2080014368 38 T 2080014368 39 T 2080014368 40 T 2080014368 42 T 2080014368 43 T 2080014368 44 T 2080014368 46 T 2080014368 47 T 2080014368 49 T 2080014368 52 T 2080014368 53 T 2080014368 56 T 2080014368 58 T 2080014368 60 T 2080014368 62 T 2080014368 67 T 2080014368 68 T 2080014368 70 T 2080014368 78 T 2080014368 79 T 2080014368 82 T 2080014368 83 T 2080014368 84 T 2080014368 85 T 2080014368 94 T 2080014368 95 T 2080014368 97 T 2080014368 99 T 2080014368 100 T 2080014368 101 T 2080014368 104 T 2080014368 106 T 2080014368 108 T 2080014368 109 T 2080014368 110 T 2080014368 111 T 2080014368 113 T 2080014368 114 T 2080014368 119 T 2080014368 120 T 2080014368 121 T 2080014368 122 T 2080014368 125 T 2080014368 127 T 2080014368 129 T 2080014368 130 T 2080014368 132 T 2080014368 140 T 2080014368 143 T 2080014368 147 T 2080014368 153 T 2080014368 157 T 2080014368 159 T 2080014368 161 T 2080014368 163 T 2080014368 1 T 2080014368 2 T 2080014368 3 T 2080014368 4 T 2080014368 5 T 2080014368 6 T 2080014368 9 T 2080014368 12 T 2080014368 13 T 2080014368 15 T 2080014368 18 T 2080014368 21 T 2080014368 28 T 2080014368 32 T 2080014368 41 T 2080014368 48 T 2080014368 50 T 2080014368 51 T 2080014368 57 T 2080014368 63 T 2080014368 64 T 2080014368 66 T 2080014368 69 T 2080014368 73 T 2080014368 74 T 2080014368 75 T 2080014368 76 T 2080014368 77 T 2080014368 96 T 2080014368 107 T 2080014368 112 T 2080014368 118 T 2080014368 135 T 2080014368 149 T 2080014368 150 T 2080014368 156 T 2080014368 45 T 2080014368 54 T 2080014368 61 T 2080014368 81 T 2080014368 86 T 2080014368 89 T 2080014368 90 T 2080014368 91 T 2080014368 98 T 2080014368 105 T 2080014368 115 T 2080014368 116 T 2080014368 117 T 2080014368 124 T 2080014368 126 T 2080014368 128 T 2080014368 131 T 2080014368 136 T 2080014368 137 T 2080014368 138 T 2080014368 139 T 2080014368 141 T 2080014368 142 T 2080014368 144 T 2080014368 145 T 2080014368 146 T 2080014368 148 T 2080014368 151 T 2080014368 152 T 2080014368 154 T 2080014368 155 T 2080014368 158 T 2080014368 162 T 2080014368 165 T 2080014368 166 STOP ********** Program terminated normally. STOP ********** Program terminated normally. T 2080014368 167 T 2080014368 7 T 2080014368 17 T 2080014368 27 T 2080014368 55 T 2080014368 59 T 2080014368 72 T 2080014368 80 T 2080014368 87 T 2080014368 88 T 2080014368 92 T 2080014368 93 T 2080014368 103 T 2080014368 123 T 2080014368 133 T 2080014368 134 T 2080014368 160 T 2080014368 35 T 2080014368 65 T 2080014368 71 T 2080014368 102 T 2080014368 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
