Sunday, September 22 2024 22:27:59
UNRES
8.73s
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CTEST_FULL_OUTPUT ishiftca= 1 ilastca= 76 init_dfa_vars finished! read_dfa_info finished! T -888735184 1 T -888735184 4 T -888735184 6 T -888735184 19 T -888735184 23 T -888735184 24 T -888735184 29 T -888735184 33 T -888735184 34 T -888735184 37 T -888735184 38 T -888735184 39 T -888735184 44 T -888735184 55 T -888735184 74 T -888735184 77 T -888735184 84 T -888735184 85 T -888735184 86 T -888735184 87 T -888735184 90 T -888735184 98 T -888735184 102 T -888735184 104 T -888735184 109 T -888735184 115 T -888735184 126 T -888735184 127 T -888735184 131 T -888735184 132 T -888735184 136 T -888735184 140 T -888735184 149 T -888735184 158 T -888735184 160 T -888735184 168 T -888735184 172 T -888735184 175 T -888735184 177 T -888735184 180 T -888735184 182 T -888735184 185 T -888735184 195 T -888735184 197 T -888735184 198 T -888735184 200 T -888735184 204 T -888735184 209 T -888735184 210 T -888735184 213 T -888735184 214 T -888735184 216 T -888735184 217 T -888735184 221 T -888735184 224 T -888735184 234 T -888735184 235 T -888735184 239 T -888735184 251 T -888735184 253 T -888735184 255 T -888735184 2 T -888735184 3 T -888735184 11 T -888735184 13 T -888735184 15 T -888735184 16 T -888735184 17 T -888735184 25 T -888735184 30 T -888735184 42 T -888735184 62 T -888735184 63 T -888735184 65 T -888735184 73 T -888735184 75 T -888735184 80 T -888735184 93 T -888735184 96 T -888735184 119 T -888735184 120 T -888735184 123 T -888735184 128 T -888735184 129 T -888735184 130 T -888735184 133 T -888735184 135 T -888735184 137 T -888735184 138 T -888735184 143 T -888735184 151 T -888735184 154 T -888735184 155 T -888735184 156 T -888735184 157 T -888735184 159 T -888735184 162 T -888735184 163 T -888735184 164 T -888735184 167 T -888735184 169 T -888735184 181 T -888735184 183 T -888735184 184 T -888735184 188 T -888735184 190 T -888735184 191 T -888735184 196 T -888735184 199 T -888735184 201 T -888735184 202 T -888735184 205 T -888735184 207 T -888735184 211 T -888735184 215 T -888735184 220 T -888735184 222 T -888735184 223 T -888735184 225 T -888735184 230 T -888735184 236 T -888735184 238 T -888735184 240 T -888735184 241 T -888735184 242 T -888735184 246 T -888735184 249 T -888735184 256 T -888735184 258 T -888735184 7 T -888735184 8 T -888735184 9 T -888735184 18 T -888735184 20 T -888735184 22 T -888735184 27 T -888735184 41 T -888735184 45 T -888735184 49 T -888735184 50 T -888735184 52 T -888735184 57 T -888735184 58 T -888735184 59 T -888735184 60 T -888735184 67 T -888735184 69 T -888735184 91 STOP ********** Program terminated normally. STOP ********** Program terminated normally. T -888735184 94 T -888735184 95 T -888735184 101 T -888735184 103 T -888735184 107 T -888735184 110 T -888735184 113 T -888735184 114 T -888735184 118 T -888735184 122 T -888735184 142 T -888735184 147 T -888735184 150 T -888735184 152 T -888735184 153 T -888735184 161 T -888735184 166 T -888735184 171 T -888735184 173 T -888735184 174 T -888735184 194 T -888735184 212 T -888735184 218 T -888735184 227 T -888735184 228 T -888735184 233 T -888735184 252 T -888735184 5 T -888735184 12 T -888735184 28 T -888735184 35 T -888735184 36 T -888735184 47 T -888735184 51 T -888735184 56 T -888735184 61 T -888735184 64 T -888735184 66 T -888735184 68 T -888735184 72 T -888735184 76 T -888735184 78 T -888735184 79 T -888735184 81 T -888735184 83 T -888735184 89 T -888735184 92 T -888735184 97 T -888735184 99 T -888735184 105 T -888735184 106 T -888735184 108 T -888735184 111 T -888735184 112 T -888735184 116 T -888735184 117 T -888735184 121 T -888735184 124 T -888735184 125 T -888735184 134 T -888735184 144 T -888735184 145 T -888735184 146 T -888735184 170 T -888735184 176 T -888735184 178 T -888735184 179 T -888735184 186 T -888735184 187 T -888735184 189 T -888735184 192 T -888735184 203 T -888735184 206 T -888735184 229 T -888735184 232 T -888735184 237 T -888735184 243 T -888735184 244 T -888735184 245 T -888735184 248 T -888735184 257 T -888735184 10 T -888735184 14 T -888735184 21 T -888735184 26 T -888735184 31 T -888735184 32 T -888735184 40 T -888735184 43 T -888735184 46 T -888735184 48 T -888735184 53 T -888735184 54 T -888735184 70 T -888735184 71 T -888735184 82 T -888735184 88 T -888735184 100 T -888735184 139 T -888735184 141 T -888735184 148 T -888735184 165 T -888735184 193 T -888735184 208 T -888735184 219 T -888735184 226 T -888735184 231 T -888735184 247 T -888735184 250 T -888735184 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
