Saturday, September 21 2024 22:00:06
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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 -1317838368 8 T -1317838368 10 T -1317838368 11 T -1317838368 14 T -1317838368 16 T -1317838368 19 T -1317838368 20 T -1317838368 22 T -1317838368 23 T -1317838368 24 T -1317838368 25 T -1317838368 26 T -1317838368 29 T -1317838368 30 T -1317838368 31 T -1317838368 33 T -1317838368 34 T -1317838368 36 T -1317838368 37 T -1317838368 38 T -1317838368 39 T -1317838368 40 T -1317838368 42 T -1317838368 43 T -1317838368 44 T -1317838368 46 T -1317838368 47 T -1317838368 49 T -1317838368 52 T -1317838368 53 T -1317838368 56 T -1317838368 58 T -1317838368 60 T -1317838368 62 T -1317838368 67 T -1317838368 68 T -1317838368 70 T -1317838368 78 T -1317838368 79 T -1317838368 82 T -1317838368 83 T -1317838368 84 T -1317838368 85 T -1317838368 94 T -1317838368 95 T -1317838368 97 T -1317838368 99 T -1317838368 100 T -1317838368 101 T -1317838368 104 T -1317838368 106 T -1317838368 108 T -1317838368 109 T -1317838368 110 T -1317838368 111 T -1317838368 113 T -1317838368 114 T -1317838368 119 T -1317838368 120 T -1317838368 121 T -1317838368 122 T -1317838368 125 T -1317838368 127 T -1317838368 129 T -1317838368 130 T -1317838368 132 T -1317838368 140 T -1317838368 143 T -1317838368 147 T -1317838368 153 T -1317838368 157 T -1317838368 159 T -1317838368 161 T -1317838368 163 T -1317838368 1 T -1317838368 2 T -1317838368 3 T -1317838368 4 T -1317838368 5 T -1317838368 6 T -1317838368 9 T -1317838368 12 T -1317838368 13 T -1317838368 15 T -1317838368 18 T -1317838368 21 T -1317838368 28 T -1317838368 32 T -1317838368 41 T -1317838368 48 T -1317838368 50 T -1317838368 51 T -1317838368 57 T -1317838368 63 T -1317838368 64 T -1317838368 66 T -1317838368 69 T -1317838368 73 T -1317838368 74 T -1317838368 75 T -1317838368 76 T -1317838368 77 T -1317838368 96 T -1317838368 107 T -1317838368 112 T -1317838368 118 T -1317838368 135 T -1317838368 149 T -1317838368 150 T -1317838368 156 T -1317838368 45 T -1317838368 54 T -1317838368 61 T -1317838368 81 T -1317838368 86 T -1317838368 89 T -1317838368 90 T -1317838368 91 T -1317838368 98 T -1317838368 105 T -1317838368 115 T -1317838368 116 T -1317838368 117 T -1317838368 124 T -1317838368 126 T -1317838368 128 T -1317838368 131 T -1317838368 136 T -1317838368 137 T -1317838368 138 T -1317838368 139 T -1317838368 141 T -1317838368 142 T -1317838368 144 T -1317838368 145 T -1317838368 146 T -1317838368 148 T -1317838368 151 T -1317838368 152 T -1317838368 154 T -1317838368 155 T -1317838368 158 T -1317838368 162 T -1317838368 165 T -1317838368 166 STOP ********** Program terminated normally. STOP ********** Program terminated normally. T -1317838368 167 T -1317838368 7 T -1317838368 17 T -1317838368 27 T -1317838368 55 T -1317838368 59 T -1317838368 72 T -1317838368 80 T -1317838368 87 T -1317838368 88 T -1317838368 92 T -1317838368 93 T -1317838368 103 T -1317838368 123 T -1317838368 133 T -1317838368 134 T -1317838368 160 T -1317838368 35 T -1317838368 65 T -1317838368 71 T -1317838368 102 T -1317838368 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
