Saturday, September 21 2024 02:11:23
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5.85s
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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 -782124224 8 T -782124224 10 T -782124224 11 T -782124224 14 T -782124224 16 T -782124224 19 T -782124224 20 T -782124224 22 T -782124224 23 T -782124224 24 T -782124224 25 T -782124224 26 T -782124224 29 T -782124224 30 T -782124224 31 T -782124224 33 T -782124224 34 T -782124224 36 T -782124224 37 T -782124224 38 T -782124224 39 T -782124224 40 T -782124224 42 T -782124224 43 T -782124224 44 T -782124224 46 T -782124224 47 T -782124224 49 T -782124224 52 T -782124224 53 T -782124224 56 T -782124224 58 T -782124224 60 T -782124224 62 T -782124224 67 T -782124224 68 T -782124224 70 T -782124224 78 T -782124224 79 T -782124224 82 T -782124224 83 T -782124224 84 T -782124224 85 T -782124224 94 T -782124224 95 T -782124224 97 T -782124224 99 T -782124224 100 T -782124224 101 T -782124224 104 T -782124224 106 T -782124224 108 T -782124224 109 T -782124224 110 T -782124224 111 T -782124224 113 T -782124224 114 T -782124224 119 T -782124224 120 T -782124224 121 T -782124224 122 T -782124224 125 T -782124224 127 T -782124224 129 T -782124224 130 T -782124224 132 T -782124224 140 T -782124224 143 T -782124224 147 T -782124224 153 T -782124224 157 T -782124224 159 T -782124224 161 T -782124224 163 T -782124224 1 T -782124224 2 T -782124224 3 T -782124224 4 T -782124224 5 T -782124224 6 T -782124224 9 T -782124224 12 T -782124224 13 T -782124224 15 T -782124224 18 T -782124224 21 T -782124224 28 T -782124224 32 T -782124224 41 T -782124224 48 T -782124224 50 T -782124224 51 T -782124224 57 T -782124224 63 T -782124224 64 T -782124224 66 T -782124224 69 T -782124224 73 T -782124224 74 T -782124224 75 T -782124224 76 T -782124224 77 T -782124224 96 T -782124224 107 T -782124224 112 T -782124224 118 T -782124224 135 T -782124224 149 T -782124224 150 T -782124224 156 T -782124224 45 T -782124224 54 T -782124224 61 T -782124224 81 T -782124224 86 T -782124224 89 T -782124224 90 T -782124224 91 T -782124224 98 T -782124224 105 T -782124224 115 T -782124224 116 T -782124224 117 T -782124224 124 T -782124224 126 T -782124224 128 T -782124224 131 T -782124224 136 T -782124224 137 T -782124224 138 T -782124224 139 T -782124224 141 T -782124224 142 T -782124224 144 T -782124224 145 T -782124224 146 T -782124224 148 T -782124224 151 T -782124224 152 T -782124224 154 T -782124224 155 T -782124224 158 T -782124224 162 T -782124224 165 T -782124224 166 STOP ********** Program terminated normally. STOP ********** Program terminated normally. T -782124224 167 T -782124224 7 T -782124224 17 T -782124224 27 T -782124224 55 T -782124224 59 T -782124224 72 T -782124224 80 T -782124224 87 T -782124224 88 T -782124224 92 T -782124224 93 T -782124224 103 T -782124224 123 T -782124224 133 T -782124224 134 T -782124224 160 T -782124224 35 T -782124224 65 T -782124224 71 T -782124224 102 T -782124224 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
