Wednesday, September 25 2024 12:28:18
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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 -1763223792 8 T -1763223792 10 T -1763223792 11 T -1763223792 14 T -1763223792 16 T -1763223792 19 T -1763223792 20 T -1763223792 22 T -1763223792 23 T -1763223792 24 T -1763223792 25 T -1763223792 26 T -1763223792 29 T -1763223792 30 T -1763223792 31 T -1763223792 33 T -1763223792 34 T -1763223792 36 T -1763223792 37 T -1763223792 38 T -1763223792 39 T -1763223792 40 T -1763223792 42 T -1763223792 43 T -1763223792 44 T -1763223792 46 T -1763223792 47 T -1763223792 49 T -1763223792 52 T -1763223792 53 T -1763223792 56 T -1763223792 58 T -1763223792 60 T -1763223792 62 T -1763223792 67 T -1763223792 68 T -1763223792 70 T -1763223792 78 T -1763223792 79 T -1763223792 82 T -1763223792 83 T -1763223792 84 T -1763223792 85 T -1763223792 94 T -1763223792 95 T -1763223792 97 T -1763223792 99 T -1763223792 100 T -1763223792 101 T -1763223792 104 T -1763223792 106 T -1763223792 108 T -1763223792 109 T -1763223792 110 T -1763223792 111 T -1763223792 113 T -1763223792 114 T -1763223792 119 T -1763223792 120 T -1763223792 121 T -1763223792 122 T -1763223792 125 T -1763223792 127 T -1763223792 129 T -1763223792 130 T -1763223792 132 T -1763223792 140 T -1763223792 143 T -1763223792 147 T -1763223792 153 T -1763223792 157 T -1763223792 159 T -1763223792 161 T -1763223792 163 T -1763223792 1 T -1763223792 2 T -1763223792 3 T -1763223792 4 T -1763223792 5 T -1763223792 6 T -1763223792 9 T -1763223792 12 T -1763223792 13 T -1763223792 15 T -1763223792 18 T -1763223792 21 T -1763223792 28 T -1763223792 32 T -1763223792 41 T -1763223792 48 T -1763223792 50 T -1763223792 51 T -1763223792 57 T -1763223792 63 T -1763223792 64 T -1763223792 66 T -1763223792 69 T -1763223792 73 T -1763223792 74 T -1763223792 75 T -1763223792 76 T -1763223792 77 T -1763223792 96 T -1763223792 107 T -1763223792 112 T -1763223792 118 T -1763223792 135 T -1763223792 149 T -1763223792 150 T -1763223792 156 T -1763223792 45 T -1763223792 54 T -1763223792 61 T -1763223792 81 T -1763223792 86 T -1763223792 89 T -1763223792 90 T -1763223792 91 T -1763223792 98 T -1763223792 105 T -1763223792 115 T -1763223792 116 T -1763223792 117 T -1763223792 124 T -1763223792 126 T -1763223792 128 T -1763223792 131 T -1763223792 136 T -1763223792 137 T -1763223792 138 T -1763223792 139 T -1763223792 141 T -1763223792 142 T -1763223792 144 T -1763223792 145 T -1763223792 146 T -1763223792 148 T -1763223792 151 T -1763223792 152 T -1763223792 154 T -1763223792 155 T -1763223792 158 T -1763223792 162 T -1763223792 165 T -1763223792 166 STOP ********** Program terminated normally. STOP ********** Program terminated normally. T -1763223792 167 T -1763223792 7 T -1763223792 17 T -1763223792 27 T -1763223792 55 T -1763223792 59 T -1763223792 72 T -1763223792 80 T -1763223792 87 T -1763223792 88 T -1763223792 92 T -1763223792 93 T -1763223792 103 T -1763223792 123 T -1763223792 133 T -1763223792 134 T -1763223792 160 T -1763223792 35 T -1763223792 65 T -1763223792 71 T -1763223792 102 T -1763223792 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
