Friday, September 20 2024 06:04:01
UNRES
4.83s
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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 2037283184 1 T 2037283184 2 T 2037283184 3 T 2037283184 4 T 2037283184 5 T 2037283184 6 T 2037283184 11 T 2037283184 12 T 2037283184 13 T 2037283184 16 T 2037283184 21 T 2037283184 22 T 2037283184 23 T 2037283184 25 T 2037283184 26 T 2037283184 28 T 2037283184 30 T 2037283184 37 T 2037283184 39 T 2037283184 42 T 2037283184 43 T 2037283184 44 T 2037283184 46 T 2037283184 47 T 2037283184 50 T 2037283184 62 T 2037283184 64 T 2037283184 65 T 2037283184 66 T 2037283184 69 T 2037283184 73 T 2037283184 74 T 2037283184 76 T 2037283184 77 T 2037283184 78 T 2037283184 81 T 2037283184 85 T 2037283184 86 T 2037283184 88 T 2037283184 89 T 2037283184 92 T 2037283184 94 T 2037283184 97 T 2037283184 98 T 2037283184 100 T 2037283184 104 T 2037283184 105 T 2037283184 106 T 2037283184 115 T 2037283184 116 T 2037283184 121 T 2037283184 123 T 2037283184 128 T 2037283184 129 T 2037283184 130 T 2037283184 138 T 2037283184 139 T 2037283184 145 T 2037283184 146 T 2037283184 148 T 2037283184 152 T 2037283184 153 T 2037283184 157 T 2037283184 167 T 2037283184 168 T 2037283184 169 T 2037283184 175 T 2037283184 180 T 2037283184 181 T 2037283184 183 T 2037283184 187 T 2037283184 190 T 2037283184 193 T 2037283184 194 T 2037283184 198 T 2037283184 200 T 2037283184 7 T 2037283184 8 T 2037283184 9 T 2037283184 10 T 2037283184 14 T 2037283184 15 T 2037283184 18 T 2037283184 24 T 2037283184 27 T 2037283184 29 T 2037283184 31 T 2037283184 33 T 2037283184 36 T 2037283184 38 T 2037283184 41 T 2037283184 45 T 2037283184 48 T 2037283184 49 T 2037283184 51 T 2037283184 52 T 2037283184 53 T 2037283184 55 T 2037283184 57 T 2037283184 60 T 2037283184 63 T 2037283184 82 T 2037283184 83 T 2037283184 84 T 2037283184 91 T 2037283184 93 T 2037283184 95 T 2037283184 96 T 2037283184 99 T 2037283184 107 T 2037283184 108 T 2037283184 110 T 2037283184 112 T 2037283184 113 T 2037283184 120 T 2037283184 122 T 2037283184 126 T 2037283184 127 T 2037283184 132 T 2037283184 143 T 2037283184 150 T 2037283184 155 T 2037283184 17 T 2037283184 20 T 2037283184 32 T 2037283184 34 T 2037283184 35 T 2037283184 40 T 2037283184 54 T 2037283184 58 T 2037283184 59 T 2037283184 67 T 2037283184 68 T 2037283184 70 T 2037283184 71 T 2037283184 72 T 2037283184 75 T 2037283184 79 T 2037283184 80 T 2037283184 87 T 2037283184 90 T 2037283184 101 T 2037283184 102 T 2037283184 103 T 2037283184 109 STOP ********** Program terminated normally. STOP ********** Program terminated normally. T 2037283184 114 T 2037283184 117 T 2037283184 118 T 2037283184 119 T 2037283184 124 T 2037283184 125 T 2037283184 131 T 2037283184 134 T 2037283184 135 T 2037283184 136 T 2037283184 137 T 2037283184 140 T 2037283184 149 T 2037283184 160 T 2037283184 161 T 2037283184 163 T 2037283184 165 T 2037283184 166 T 2037283184 174 T 2037283184 176 T 2037283184 177 T 2037283184 179 T 2037283184 182 T 2037283184 184 T 2037283184 185 T 2037283184 188 T 2037283184 195 T 2037283184 19 T 2037283184 56 T 2037283184 61 T 2037283184 111 T 2037283184 133 T 2037283184 141 T 2037283184 142 T 2037283184 144 T 2037283184 147 T 2037283184 151 T 2037283184 156 T 2037283184 158 T 2037283184 162 T 2037283184 164 T 2037283184 170 T 2037283184 171 T 2037283184 172 T 2037283184 173 T 2037283184 178 T 2037283184 189 T 2037283184 191 T 2037283184 192 T 2037283184 196 T 2037283184 197 T 2037283184 199 T 2037283184 201 T 2037283184 202 T 2037283184 204 T 2037283184 154 T 2037283184 159 T 2037283184 186 T 2037283184 203 THERE ARE 5 FAMILIES OF CONFORMATIONS dfa_wham_T280K_0001.pdb:REMARK CLUSTER 1 FREE ENERGY -5.19720E+02 AVE RMSD 0.00 dfa_wham_T280K_0001.pdb:REMARK clustering ENERGY -5.17615E+02 RMS 0.00 dfa_wham_T280K_0002.pdb:REMARK CLUSTER 2 FREE ENERGY -5.19550E+02 AVE RMSD 0.00 dfa_wham_T280K_0002.pdb:REMARK clustering ENERGY -5.17612E+02 RMS 0.00 dfa_wham_T280K_0003.pdb:REMARK CLUSTER 3 FREE ENERGY -5.19353E+02 AVE RMSD 0.00 dfa_wham_T280K_0003.pdb:REMARK clustering ENERGY -5.17609E+02 RMS 0.00 dfa_wham_T280K_0004.pdb:REMARK CLUSTER 4 FREE ENERGY -5.18599E+02 AVE RMSD 0.00 dfa_wham_T280K_0004.pdb:REMARK clustering ENERGY -5.17608E+02 RMS 0.00 dfa_wham_T280K_0005.pdb:REMARK CLUSTER 5 FREE ENERGY -5.17076E+02 AVE RMSD 0.00 dfa_wham_T280K_0005.pdb:REMARK clustering ENERGY -5.16622E+02 RMS 0.00
