Sunday, September 22 2024 00:40:20
UNRES
5.49s
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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 170285232 1 T 170285232 4 T 170285232 6 T 170285232 19 T 170285232 23 T 170285232 24 T 170285232 29 T 170285232 33 T 170285232 34 T 170285232 37 T 170285232 38 T 170285232 39 T 170285232 44 T 170285232 55 T 170285232 74 T 170285232 77 T 170285232 84 T 170285232 85 T 170285232 86 T 170285232 87 T 170285232 90 T 170285232 98 T 170285232 102 T 170285232 104 T 170285232 109 T 170285232 115 T 170285232 126 T 170285232 127 T 170285232 131 T 170285232 132 T 170285232 136 T 170285232 140 T 170285232 149 T 170285232 158 T 170285232 160 T 170285232 168 T 170285232 172 T 170285232 175 T 170285232 177 T 170285232 180 T 170285232 182 T 170285232 185 T 170285232 195 T 170285232 197 T 170285232 198 T 170285232 200 T 170285232 204 T 170285232 209 T 170285232 210 T 170285232 213 T 170285232 214 T 170285232 216 T 170285232 217 T 170285232 221 T 170285232 224 T 170285232 234 T 170285232 235 T 170285232 239 T 170285232 251 T 170285232 253 T 170285232 255 T 170285232 2 T 170285232 3 T 170285232 11 T 170285232 13 T 170285232 15 T 170285232 16 T 170285232 17 T 170285232 25 T 170285232 30 T 170285232 42 T 170285232 62 T 170285232 63 T 170285232 65 T 170285232 73 T 170285232 75 T 170285232 80 T 170285232 93 T 170285232 96 T 170285232 119 T 170285232 120 T 170285232 123 T 170285232 128 T 170285232 129 T 170285232 130 T 170285232 133 T 170285232 135 T 170285232 137 T 170285232 138 T 170285232 143 T 170285232 151 T 170285232 154 T 170285232 155 T 170285232 156 T 170285232 157 T 170285232 159 T 170285232 162 T 170285232 163 T 170285232 164 T 170285232 167 T 170285232 169 T 170285232 181 T 170285232 183 T 170285232 184 T 170285232 188 T 170285232 190 T 170285232 191 T 170285232 196 T 170285232 199 T 170285232 201 T 170285232 202 T 170285232 205 T 170285232 207 T 170285232 211 T 170285232 215 T 170285232 220 T 170285232 222 T 170285232 223 T 170285232 225 T 170285232 230 T 170285232 236 T 170285232 238 T 170285232 240 T 170285232 241 T 170285232 242 T 170285232 246 T 170285232 249 T 170285232 256 T 170285232 258 T 170285232 7 T 170285232 8 T 170285232 9 T 170285232 18 T 170285232 20 T 170285232 22 T 170285232 27 T 170285232 41 T 170285232 45 T 170285232 49 T 170285232 50 T 170285232 52 T 170285232 57 T 170285232 58 T 170285232 59 T 170285232 60 STOP ********** Program terminated normally. STOP ********** Program terminated normally. T 170285232 67 T 170285232 69 T 170285232 91 T 170285232 94 T 170285232 95 T 170285232 101 T 170285232 103 T 170285232 107 T 170285232 110 T 170285232 113 T 170285232 114 T 170285232 118 T 170285232 122 T 170285232 142 T 170285232 147 T 170285232 150 T 170285232 152 T 170285232 153 T 170285232 161 T 170285232 166 T 170285232 171 T 170285232 173 T 170285232 174 T 170285232 194 T 170285232 212 T 170285232 218 T 170285232 227 T 170285232 228 T 170285232 233 T 170285232 252 T 170285232 5 T 170285232 12 T 170285232 28 T 170285232 35 T 170285232 36 T 170285232 47 T 170285232 51 T 170285232 56 T 170285232 61 T 170285232 64 T 170285232 66 T 170285232 68 T 170285232 72 T 170285232 76 T 170285232 78 T 170285232 79 T 170285232 81 T 170285232 83 T 170285232 89 T 170285232 92 T 170285232 97 T 170285232 99 T 170285232 105 T 170285232 106 T 170285232 108 T 170285232 111 T 170285232 112 T 170285232 116 T 170285232 117 T 170285232 121 T 170285232 124 T 170285232 125 T 170285232 134 T 170285232 144 T 170285232 145 T 170285232 146 T 170285232 170 T 170285232 176 T 170285232 178 T 170285232 179 T 170285232 186 T 170285232 187 T 170285232 189 T 170285232 192 T 170285232 203 T 170285232 206 T 170285232 229 T 170285232 232 T 170285232 237 T 170285232 243 T 170285232 244 T 170285232 245 T 170285232 248 T 170285232 257 T 170285232 10 T 170285232 14 T 170285232 21 T 170285232 26 T 170285232 31 T 170285232 32 T 170285232 40 T 170285232 43 T 170285232 46 T 170285232 48 T 170285232 53 T 170285232 54 T 170285232 70 T 170285232 71 T 170285232 82 T 170285232 88 T 170285232 100 T 170285232 139 T 170285232 141 T 170285232 148 T 170285232 165 T 170285232 193 T 170285232 208 T 170285232 219 T 170285232 226 T 170285232 231 T 170285232 247 T 170285232 250 T 170285232 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
