Saturday, September 21 2024 23:34:41
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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 -1956420768 8 T -1956420768 10 T -1956420768 11 T -1956420768 14 T -1956420768 16 T -1956420768 19 T -1956420768 20 T -1956420768 22 T -1956420768 23 T -1956420768 24 T -1956420768 25 T -1956420768 26 T -1956420768 29 T -1956420768 30 T -1956420768 31 T -1956420768 33 T -1956420768 34 T -1956420768 36 T -1956420768 37 T -1956420768 38 T -1956420768 39 T -1956420768 40 T -1956420768 42 T -1956420768 43 T -1956420768 44 T -1956420768 46 T -1956420768 47 T -1956420768 49 T -1956420768 52 T -1956420768 53 T -1956420768 56 T -1956420768 58 T -1956420768 60 T -1956420768 62 T -1956420768 67 T -1956420768 68 T -1956420768 70 T -1956420768 78 T -1956420768 79 T -1956420768 82 T -1956420768 83 T -1956420768 84 T -1956420768 85 T -1956420768 94 T -1956420768 95 T -1956420768 97 T -1956420768 99 T -1956420768 100 T -1956420768 101 T -1956420768 104 T -1956420768 106 T -1956420768 108 T -1956420768 109 T -1956420768 110 T -1956420768 111 T -1956420768 113 T -1956420768 114 T -1956420768 119 T -1956420768 120 T -1956420768 121 T -1956420768 122 T -1956420768 125 T -1956420768 127 T -1956420768 129 T -1956420768 130 T -1956420768 132 T -1956420768 140 T -1956420768 143 T -1956420768 147 T -1956420768 153 T -1956420768 157 T -1956420768 159 T -1956420768 161 T -1956420768 163 T -1956420768 1 T -1956420768 2 T -1956420768 3 T -1956420768 4 T -1956420768 5 T -1956420768 6 T -1956420768 9 T -1956420768 12 T -1956420768 13 T -1956420768 15 T -1956420768 18 T -1956420768 21 T -1956420768 28 T -1956420768 32 T -1956420768 41 T -1956420768 48 T -1956420768 50 T -1956420768 51 T -1956420768 57 T -1956420768 63 T -1956420768 64 T -1956420768 66 T -1956420768 69 T -1956420768 73 T -1956420768 74 T -1956420768 75 T -1956420768 76 T -1956420768 77 T -1956420768 96 T -1956420768 107 T -1956420768 112 T -1956420768 118 T -1956420768 135 T -1956420768 149 T -1956420768 150 T -1956420768 156 T -1956420768 45 T -1956420768 54 T -1956420768 61 T -1956420768 81 T -1956420768 86 T -1956420768 89 T -1956420768 90 T -1956420768 91 T -1956420768 98 T -1956420768 105 T -1956420768 115 T -1956420768 116 T -1956420768 117 T -1956420768 124 T -1956420768 126 T -1956420768 128 T -1956420768 131 T -1956420768 136 T -1956420768 137 T -1956420768 138 T -1956420768 139 T -1956420768 141 T -1956420768 142 T -1956420768 144 T -1956420768 145 T -1956420768 146 T -1956420768 148 T -1956420768 151 T -1956420768 152 T -1956420768 154 T -1956420768 155 T -1956420768 158 T -1956420768 162 T -1956420768 165 T -1956420768 166 STOP ********** Program terminated normally. STOP ********** Program terminated normally. T -1956420768 167 T -1956420768 7 T -1956420768 17 T -1956420768 27 T -1956420768 55 T -1956420768 59 T -1956420768 72 T -1956420768 80 T -1956420768 87 T -1956420768 88 T -1956420768 92 T -1956420768 93 T -1956420768 103 T -1956420768 123 T -1956420768 133 T -1956420768 134 T -1956420768 160 T -1956420768 35 T -1956420768 65 T -1956420768 71 T -1956420768 102 T -1956420768 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
