Saturday, September 21 2024 10:21:35
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5.17s
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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 -1843011568 8 T -1843011568 10 T -1843011568 11 T -1843011568 14 T -1843011568 16 T -1843011568 19 T -1843011568 20 T -1843011568 22 T -1843011568 23 T -1843011568 24 T -1843011568 25 T -1843011568 26 T -1843011568 29 T -1843011568 30 T -1843011568 31 T -1843011568 33 T -1843011568 34 T -1843011568 36 T -1843011568 37 T -1843011568 38 T -1843011568 39 T -1843011568 40 T -1843011568 42 T -1843011568 43 T -1843011568 44 T -1843011568 46 T -1843011568 47 T -1843011568 49 T -1843011568 52 T -1843011568 53 T -1843011568 56 T -1843011568 58 T -1843011568 60 T -1843011568 62 T -1843011568 67 T -1843011568 68 T -1843011568 70 T -1843011568 78 T -1843011568 79 T -1843011568 82 T -1843011568 83 T -1843011568 84 T -1843011568 85 T -1843011568 94 T -1843011568 95 T -1843011568 97 T -1843011568 99 T -1843011568 100 T -1843011568 101 T -1843011568 104 T -1843011568 106 T -1843011568 108 T -1843011568 109 T -1843011568 110 T -1843011568 111 T -1843011568 113 T -1843011568 114 T -1843011568 119 T -1843011568 120 T -1843011568 121 T -1843011568 122 T -1843011568 125 T -1843011568 127 T -1843011568 129 T -1843011568 130 T -1843011568 132 T -1843011568 140 T -1843011568 143 T -1843011568 147 T -1843011568 153 T -1843011568 157 T -1843011568 159 T -1843011568 161 T -1843011568 163 T -1843011568 1 T -1843011568 2 T -1843011568 3 T -1843011568 4 T -1843011568 5 T -1843011568 6 T -1843011568 9 T -1843011568 12 T -1843011568 13 T -1843011568 15 T -1843011568 18 T -1843011568 21 T -1843011568 28 T -1843011568 32 T -1843011568 41 T -1843011568 48 T -1843011568 50 T -1843011568 51 T -1843011568 57 T -1843011568 63 T -1843011568 64 T -1843011568 66 T -1843011568 69 T -1843011568 73 T -1843011568 74 T -1843011568 75 T -1843011568 76 T -1843011568 77 T -1843011568 96 T -1843011568 107 T -1843011568 112 T -1843011568 118 T -1843011568 135 T -1843011568 149 T -1843011568 150 T -1843011568 156 T -1843011568 45 T -1843011568 54 T -1843011568 61 T -1843011568 81 T -1843011568 86 T -1843011568 89 T -1843011568 90 T -1843011568 91 T -1843011568 98 T -1843011568 105 T -1843011568 115 T -1843011568 116 T -1843011568 117 T -1843011568 124 T -1843011568 126 T -1843011568 128 T -1843011568 131 T -1843011568 136 T -1843011568 137 T -1843011568 138 T -1843011568 139 T -1843011568 141 T -1843011568 142 T -1843011568 144 T -1843011568 145 T -1843011568 146 T -1843011568 148 T -1843011568 151 T -1843011568 152 T -1843011568 154 T -1843011568 155 T -1843011568 158 T -1843011568 162 T -1843011568 165 T -1843011568 166 STOP ********** Program terminated normally. STOP ********** Program terminated normally. T -1843011568 167 T -1843011568 7 T -1843011568 17 T -1843011568 27 T -1843011568 55 T -1843011568 59 T -1843011568 72 T -1843011568 80 T -1843011568 87 T -1843011568 88 T -1843011568 92 T -1843011568 93 T -1843011568 103 T -1843011568 123 T -1843011568 133 T -1843011568 134 T -1843011568 160 T -1843011568 35 T -1843011568 65 T -1843011568 71 T -1843011568 102 T -1843011568 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
