Tuesday, September 24 2024 10:34:38
UNRES
4.87s
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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 628749920 8 T 628749920 10 T 628749920 11 T 628749920 14 T 628749920 16 T 628749920 19 T 628749920 20 T 628749920 22 T 628749920 23 T 628749920 24 T 628749920 25 T 628749920 26 T 628749920 29 T 628749920 30 T 628749920 31 T 628749920 33 T 628749920 34 T 628749920 36 T 628749920 37 T 628749920 38 T 628749920 39 T 628749920 40 T 628749920 42 T 628749920 43 T 628749920 44 T 628749920 46 T 628749920 47 T 628749920 49 T 628749920 52 T 628749920 53 T 628749920 56 T 628749920 58 T 628749920 60 T 628749920 62 T 628749920 67 T 628749920 68 T 628749920 70 T 628749920 78 T 628749920 79 T 628749920 82 T 628749920 83 T 628749920 84 T 628749920 85 T 628749920 94 T 628749920 95 T 628749920 97 T 628749920 99 T 628749920 100 T 628749920 101 T 628749920 104 T 628749920 106 T 628749920 108 T 628749920 109 T 628749920 110 T 628749920 111 T 628749920 113 T 628749920 114 T 628749920 119 T 628749920 120 T 628749920 121 T 628749920 122 T 628749920 125 T 628749920 127 T 628749920 129 T 628749920 130 T 628749920 132 T 628749920 140 T 628749920 143 T 628749920 147 T 628749920 153 T 628749920 157 T 628749920 159 T 628749920 161 T 628749920 163 T 628749920 1 T 628749920 2 T 628749920 3 T 628749920 4 T 628749920 5 T 628749920 6 T 628749920 9 T 628749920 12 T 628749920 13 T 628749920 15 T 628749920 18 T 628749920 21 T 628749920 28 T 628749920 32 T 628749920 41 T 628749920 48 T 628749920 50 T 628749920 51 T 628749920 57 T 628749920 63 T 628749920 64 T 628749920 66 T 628749920 69 T 628749920 73 T 628749920 74 T 628749920 75 T 628749920 76 T 628749920 77 T 628749920 96 T 628749920 107 T 628749920 112 T 628749920 118 T 628749920 135 T 628749920 149 T 628749920 150 T 628749920 156 T 628749920 45 T 628749920 54 T 628749920 61 T 628749920 81 T 628749920 86 T 628749920 89 T 628749920 90 T 628749920 91 T 628749920 98 T 628749920 105 T 628749920 115 T 628749920 116 T 628749920 117 T 628749920 124 T 628749920 126 T 628749920 128 T 628749920 131 T 628749920 136 T 628749920 137 T 628749920 138 T 628749920 139 T 628749920 141 T 628749920 142 T 628749920 144 T 628749920 145 T 628749920 146 T 628749920 148 T 628749920 151 T 628749920 152 T 628749920 154 T 628749920 155 T 628749920 158 T 628749920 162 T 628749920 165 T 628749920 166 STOP ********** Program terminated normally. STOP ********** Program terminated normally. T 628749920 167 T 628749920 7 T 628749920 17 T 628749920 27 T 628749920 55 T 628749920 59 T 628749920 72 T 628749920 80 T 628749920 87 T 628749920 88 T 628749920 92 T 628749920 93 T 628749920 103 T 628749920 123 T 628749920 133 T 628749920 134 T 628749920 160 T 628749920 35 T 628749920 65 T 628749920 71 T 628749920 102 T 628749920 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
