Sunday, September 22 2024 10:46:26
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6.51s
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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 -808544384 8 T -808544384 10 T -808544384 11 T -808544384 14 T -808544384 16 T -808544384 19 T -808544384 20 T -808544384 22 T -808544384 23 T -808544384 24 T -808544384 25 T -808544384 26 T -808544384 29 T -808544384 30 T -808544384 31 T -808544384 33 T -808544384 34 T -808544384 36 T -808544384 37 T -808544384 38 T -808544384 39 T -808544384 40 T -808544384 42 T -808544384 43 T -808544384 44 T -808544384 46 T -808544384 47 T -808544384 49 T -808544384 52 T -808544384 53 T -808544384 56 T -808544384 58 T -808544384 60 T -808544384 62 T -808544384 67 T -808544384 68 T -808544384 70 T -808544384 78 T -808544384 79 T -808544384 82 T -808544384 83 T -808544384 84 T -808544384 85 T -808544384 94 T -808544384 95 T -808544384 97 T -808544384 99 T -808544384 100 T -808544384 101 T -808544384 104 T -808544384 106 T -808544384 108 T -808544384 109 T -808544384 110 T -808544384 111 T -808544384 113 T -808544384 114 T -808544384 119 T -808544384 120 T -808544384 121 T -808544384 122 T -808544384 125 T -808544384 127 T -808544384 129 T -808544384 130 T -808544384 132 T -808544384 140 T -808544384 143 T -808544384 147 T -808544384 153 T -808544384 157 T -808544384 159 T -808544384 161 T -808544384 163 T -808544384 1 T -808544384 2 T -808544384 3 T -808544384 4 T -808544384 5 T -808544384 6 T -808544384 9 T -808544384 12 T -808544384 13 T -808544384 15 T -808544384 18 T -808544384 21 T -808544384 28 T -808544384 32 T -808544384 41 T -808544384 48 T -808544384 50 T -808544384 51 T -808544384 57 T -808544384 63 T -808544384 64 T -808544384 66 T -808544384 69 T -808544384 73 T -808544384 74 T -808544384 75 T -808544384 76 T -808544384 77 T -808544384 96 T -808544384 107 T -808544384 112 T -808544384 118 T -808544384 135 T -808544384 149 T -808544384 150 T -808544384 156 T -808544384 45 T -808544384 54 T -808544384 61 T -808544384 81 T -808544384 86 T -808544384 89 T -808544384 90 T -808544384 91 T -808544384 98 T -808544384 105 T -808544384 115 T -808544384 116 T -808544384 117 T -808544384 124 T -808544384 126 T -808544384 128 T -808544384 131 T -808544384 136 T -808544384 137 T -808544384 138 T -808544384 139 T -808544384 141 T -808544384 142 T -808544384 144 T -808544384 145 T -808544384 146 T -808544384 148 T -808544384 151 T -808544384 152 T -808544384 154 T -808544384 155 T -808544384 158 T -808544384 162 T -808544384 165 T -808544384 166 STOP ********** Program terminated normally. STOP ********** Program terminated normally. T -808544384 167 T -808544384 7 T -808544384 17 T -808544384 27 T -808544384 55 T -808544384 59 T -808544384 72 T -808544384 80 T -808544384 87 T -808544384 88 T -808544384 92 T -808544384 93 T -808544384 103 T -808544384 123 T -808544384 133 T -808544384 134 T -808544384 160 T -808544384 35 T -808544384 65 T -808544384 71 T -808544384 102 T -808544384 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
