Friday, September 20 2024 04:27:20
UNRES
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CTEST_FULL_OUTPUT ishiftca= 1 ilastca= 76 init_dfa_vars finished! ishiftca= 1 ilastca= 76 init_dfa_vars finished! read_dfa_info finished! T 52759840 1 T 52759840 2 T 52759840 4 T 52759840 5 T 52759840 7 T 52759840 9 T 52759840 10 T 52759840 11 T 52759840 12 T 52759840 16 T 52759840 17 T 52759840 18 T 52759840 19 T 52759840 21 T 52759840 22 T 52759840 23 T 52759840 24 T 52759840 25 T 52759840 26 T 52759840 27 T 52759840 32 T 52759840 33 T 52759840 35 T 52759840 37 T 52759840 38 T 52759840 39 T 52759840 42 T 52759840 43 T 52759840 50 T 52759840 55 T 52759840 57 T 52759840 58 T 52759840 60 T 52759840 62 T 52759840 63 T 52759840 67 T 52759840 70 T 52759840 72 T 52759840 74 T 52759840 79 T 52759840 80 T 52759840 82 T 52759840 86 T 52759840 92 T 52759840 93 T 52759840 95 T 52759840 97 T 52759840 98 T 52759840 103 T 52759840 104 T 52759840 107 T 52759840 108 T 52759840 110 T 52759840 111 T 52759840 112 T 52759840 113 T 52759840 114 T 52759840 118 T 52759840 120 T 52759840 121 T 52759840 122 T 52759840 124 T 52759840 125 T 52759840 129 T 52759840 130 T 52759840 133 T 52759840 139 T 52759840 141 T 52759840 145 T 52759840 152 T 52759840 156 T 52759840 157 T 52759840 158 T 52759840 164 T 52759840 3 T 52759840 6 T 52759840 8 T 52759840 13 T 52759840 15 T 52759840 28 T 52759840 30 T 52759840 31 T 52759840 36 T 52759840 40 T 52759840 41 T 52759840 45 T 52759840 48 T 52759840 51 T 52759840 52 T 52759840 53 T 52759840 54 T 52759840 56 T 52759840 59 T 52759840 64 T 52759840 65 T 52759840 69 T 52759840 71 T 52759840 75 T 52759840 76 T 52759840 77 T 52759840 83 T 52759840 88 T 52759840 100 T 52759840 105 T 52759840 109 T 52759840 116 T 52759840 134 T 52759840 148 T 52759840 150 T 52759840 160 T 52759840 44 T 52759840 46 T 52759840 47 T 52759840 81 T 52759840 84 T 52759840 89 T 52759840 91 T 52759840 94 T 52759840 99 T 52759840 102 T 52759840 115 T 52759840 117 T 52759840 119 T 52759840 126 T 52759840 127 T 52759840 128 T 52759840 131 T 52759840 132 T 52759840 137 T 52759840 138 T 52759840 140 T 52759840 142 T 52759840 143 T 52759840 144 T 52759840 146 T 52759840 147 T 52759840 149 T 52759840 151 T 52759840 153 T 52759840 154 T 52759840 155 T 52759840 159 T 52759840 163 T 52759840 165 T 52759840 166 STOP ********** Program terminated normally. STOP ********** Program terminated normally. T 52759840 167 T 52759840 14 T 52759840 20 T 52759840 29 T 52759840 49 T 52759840 66 T 52759840 68 T 52759840 78 T 52759840 85 T 52759840 87 T 52759840 90 T 52759840 96 T 52759840 106 T 52759840 123 T 52759840 135 T 52759840 136 T 52759840 161 T 52759840 34 T 52759840 61 T 52759840 73 T 52759840 101 T 52759840 162 THERE ARE 5 FAMILIES OF CONFORMATIONS dfa_wham_T280K_0001.pdb:REMARK CLUSTER 1 FREE ENERGY -8.98593E+02 AVE RMSD 0.00 dfa_wham_T280K_0001.pdb:REMARK clustering ENERGY -8.96420E+02 RMS 0.00 dfa_wham_T280K_0002.pdb:REMARK CLUSTER 2 FREE ENERGY -8.98250E+02 AVE RMSD 0.00 dfa_wham_T280K_0002.pdb:REMARK clustering ENERGY -8.96419E+02 RMS 0.00 dfa_wham_T280K_0003.pdb:REMARK CLUSTER 3 FREE ENERGY -8.97790E+02 AVE RMSD 0.00 dfa_wham_T280K_0003.pdb:REMARK clustering ENERGY -8.96369E+02 RMS 0.00 dfa_wham_T280K_0004.pdb:REMARK CLUSTER 4 FREE ENERGY -8.97700E+02 AVE RMSD 0.00 dfa_wham_T280K_0004.pdb:REMARK clustering ENERGY -8.96415E+02 RMS 0.00 dfa_wham_T280K_0005.pdb:REMARK CLUSTER 5 FREE ENERGY -8.97050E+02 AVE RMSD 0.00 dfa_wham_T280K_0005.pdb:REMARK clustering ENERGY -8.96388E+02 RMS 0.00
