Tuesday, September 24 2024 16:29:55
UNRES
5.14s
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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 1678232944 1 T 1678232944 4 T 1678232944 6 T 1678232944 19 T 1678232944 23 T 1678232944 24 T 1678232944 29 T 1678232944 33 T 1678232944 34 T 1678232944 37 T 1678232944 38 T 1678232944 39 T 1678232944 44 T 1678232944 55 T 1678232944 74 T 1678232944 77 T 1678232944 84 T 1678232944 85 T 1678232944 86 T 1678232944 87 T 1678232944 90 T 1678232944 98 T 1678232944 102 T 1678232944 104 T 1678232944 109 T 1678232944 115 T 1678232944 126 T 1678232944 127 T 1678232944 131 T 1678232944 132 T 1678232944 136 T 1678232944 140 T 1678232944 149 T 1678232944 158 T 1678232944 160 T 1678232944 168 T 1678232944 172 T 1678232944 175 T 1678232944 177 T 1678232944 180 T 1678232944 182 T 1678232944 185 T 1678232944 195 T 1678232944 197 T 1678232944 198 T 1678232944 200 T 1678232944 204 T 1678232944 209 T 1678232944 210 T 1678232944 213 T 1678232944 214 T 1678232944 216 T 1678232944 217 T 1678232944 221 T 1678232944 224 T 1678232944 234 T 1678232944 235 T 1678232944 239 T 1678232944 251 T 1678232944 253 T 1678232944 255 T 1678232944 2 T 1678232944 3 T 1678232944 11 T 1678232944 13 T 1678232944 15 T 1678232944 16 T 1678232944 17 T 1678232944 25 T 1678232944 30 T 1678232944 42 T 1678232944 62 T 1678232944 63 T 1678232944 65 T 1678232944 73 T 1678232944 75 T 1678232944 80 T 1678232944 93 T 1678232944 96 T 1678232944 119 T 1678232944 120 T 1678232944 123 T 1678232944 128 T 1678232944 129 T 1678232944 130 T 1678232944 133 T 1678232944 135 T 1678232944 137 T 1678232944 138 T 1678232944 143 T 1678232944 151 T 1678232944 154 T 1678232944 155 T 1678232944 156 T 1678232944 157 T 1678232944 159 T 1678232944 162 T 1678232944 163 T 1678232944 164 T 1678232944 167 T 1678232944 169 T 1678232944 181 T 1678232944 183 T 1678232944 184 T 1678232944 188 T 1678232944 190 T 1678232944 191 T 1678232944 196 T 1678232944 199 T 1678232944 201 T 1678232944 202 T 1678232944 205 T 1678232944 207 T 1678232944 211 T 1678232944 215 T 1678232944 220 T 1678232944 222 T 1678232944 223 T 1678232944 225 T 1678232944 230 T 1678232944 236 T 1678232944 238 T 1678232944 240 T 1678232944 241 T 1678232944 242 T 1678232944 246 T 1678232944 249 T 1678232944 256 T 1678232944 258 T 1678232944 7 T 1678232944 8 T 1678232944 9 T 1678232944 18 T 1678232944 20 T 1678232944 22 T 1678232944 27 T 1678232944 41 T 1678232944 45 T 1678232944 49 T 1678232944 50 T 1678232944 52 T 1678232944 57 T 1678232944 58 T 1678232944 59 T 1678232944 60 STOP ********** Program terminated normally. STOP ********** Program terminated normally. T 1678232944 67 T 1678232944 69 T 1678232944 91 T 1678232944 94 T 1678232944 95 T 1678232944 101 T 1678232944 103 T 1678232944 107 T 1678232944 110 T 1678232944 113 T 1678232944 114 T 1678232944 118 T 1678232944 122 T 1678232944 142 T 1678232944 147 T 1678232944 150 T 1678232944 152 T 1678232944 153 T 1678232944 161 T 1678232944 166 T 1678232944 171 T 1678232944 173 T 1678232944 174 T 1678232944 194 T 1678232944 212 T 1678232944 218 T 1678232944 227 T 1678232944 228 T 1678232944 233 T 1678232944 252 T 1678232944 5 T 1678232944 12 T 1678232944 28 T 1678232944 35 T 1678232944 36 T 1678232944 47 T 1678232944 51 T 1678232944 56 T 1678232944 61 T 1678232944 64 T 1678232944 66 T 1678232944 68 T 1678232944 72 T 1678232944 76 T 1678232944 78 T 1678232944 79 T 1678232944 81 T 1678232944 83 T 1678232944 89 T 1678232944 92 T 1678232944 97 T 1678232944 99 T 1678232944 105 T 1678232944 106 T 1678232944 108 T 1678232944 111 T 1678232944 112 T 1678232944 116 T 1678232944 117 T 1678232944 121 T 1678232944 124 T 1678232944 125 T 1678232944 134 T 1678232944 144 T 1678232944 145 T 1678232944 146 T 1678232944 170 T 1678232944 176 T 1678232944 178 T 1678232944 179 T 1678232944 186 T 1678232944 187 T 1678232944 189 T 1678232944 192 T 1678232944 203 T 1678232944 206 T 1678232944 229 T 1678232944 232 T 1678232944 237 T 1678232944 243 T 1678232944 244 T 1678232944 245 T 1678232944 248 T 1678232944 257 T 1678232944 10 T 1678232944 14 T 1678232944 21 T 1678232944 26 T 1678232944 31 T 1678232944 32 T 1678232944 40 T 1678232944 43 T 1678232944 46 T 1678232944 48 T 1678232944 53 T 1678232944 54 T 1678232944 70 T 1678232944 71 T 1678232944 82 T 1678232944 88 T 1678232944 100 T 1678232944 139 T 1678232944 141 T 1678232944 148 T 1678232944 165 T 1678232944 193 T 1678232944 208 T 1678232944 219 T 1678232944 226 T 1678232944 231 T 1678232944 247 T 1678232944 250 T 1678232944 254 THERE ARE 5 FAMILIES OF CONFORMATIONS dfa_wham_T280K_0001.pdb:REMARK CLUSTER 1 FREE ENERGY -5.27237E+02 AVE RMSD 0.00 dfa_wham_T280K_0001.pdb:REMARK clustering ENERGY -5.25449E+02 RMS 0.00 dfa_wham_T280K_0002.pdb:REMARK CLUSTER 2 FREE ENERGY -5.27201E+02 AVE RMSD 0.00 dfa_wham_T280K_0002.pdb:REMARK clustering ENERGY -5.25448E+02 RMS 0.00 dfa_wham_T280K_0003.pdb:REMARK CLUSTER 3 FREE ENERGY -5.27199E+02 AVE RMSD 0.00 dfa_wham_T280K_0003.pdb:REMARK clustering ENERGY -5.25446E+02 RMS 0.00 dfa_wham_T280K_0004.pdb:REMARK CLUSTER 4 FREE ENERGY -5.27195E+02 AVE RMSD 0.00 dfa_wham_T280K_0004.pdb:REMARK clustering ENERGY -5.25447E+02 RMS 0.00 dfa_wham_T280K_0005.pdb:REMARK CLUSTER 5 FREE ENERGY -5.26973E+02 AVE RMSD 0.00 dfa_wham_T280K_0005.pdb:REMARK clustering ENERGY -5.25446E+02 RMS 0.00
