Thursday, September 19 2024 20:42:39
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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 -1637725680 1 T -1637725680 2 T -1637725680 3 T -1637725680 4 T -1637725680 5 T -1637725680 6 T -1637725680 11 T -1637725680 12 T -1637725680 13 T -1637725680 16 T -1637725680 21 T -1637725680 22 T -1637725680 23 T -1637725680 25 T -1637725680 26 T -1637725680 28 T -1637725680 30 T -1637725680 37 T -1637725680 39 T -1637725680 42 T -1637725680 43 T -1637725680 44 T -1637725680 46 T -1637725680 47 T -1637725680 50 T -1637725680 62 T -1637725680 64 T -1637725680 65 T -1637725680 66 T -1637725680 69 T -1637725680 73 T -1637725680 74 T -1637725680 76 T -1637725680 77 T -1637725680 78 T -1637725680 81 T -1637725680 85 T -1637725680 86 T -1637725680 88 T -1637725680 89 T -1637725680 92 T -1637725680 94 T -1637725680 97 T -1637725680 98 T -1637725680 100 T -1637725680 104 T -1637725680 105 T -1637725680 106 T -1637725680 115 T -1637725680 116 T -1637725680 121 T -1637725680 123 T -1637725680 128 T -1637725680 129 T -1637725680 130 T -1637725680 138 T -1637725680 139 T -1637725680 145 T -1637725680 146 T -1637725680 148 T -1637725680 152 T -1637725680 153 T -1637725680 157 T -1637725680 167 T -1637725680 168 T -1637725680 169 T -1637725680 175 T -1637725680 180 T -1637725680 181 T -1637725680 183 T -1637725680 187 T -1637725680 190 T -1637725680 193 T -1637725680 194 T -1637725680 198 T -1637725680 200 T -1637725680 7 T -1637725680 8 T -1637725680 9 T -1637725680 10 T -1637725680 14 T -1637725680 15 T -1637725680 18 T -1637725680 24 T -1637725680 27 T -1637725680 29 T -1637725680 31 T -1637725680 33 T -1637725680 36 T -1637725680 38 T -1637725680 41 T -1637725680 45 T -1637725680 48 T -1637725680 49 T -1637725680 51 T -1637725680 52 T -1637725680 53 T -1637725680 55 T -1637725680 57 T -1637725680 60 T -1637725680 63 T -1637725680 82 T -1637725680 83 T -1637725680 84 T -1637725680 91 T -1637725680 93 T -1637725680 95 T -1637725680 96 T -1637725680 99 T -1637725680 107 T -1637725680 108 T -1637725680 110 T -1637725680 112 T -1637725680 113 T -1637725680 120 T -1637725680 122 T -1637725680 126 T -1637725680 127 T -1637725680 132 T -1637725680 143 T -1637725680 150 T -1637725680 155 T -1637725680 17 T -1637725680 20 T -1637725680 32 T -1637725680 34 T -1637725680 35 T -1637725680 40 T -1637725680 54 T -1637725680 58 T -1637725680 59 T -1637725680 67 T -1637725680 68 T -1637725680 70 T -1637725680 71 T -1637725680 72 T -1637725680 75 T -1637725680 79 T -1637725680 80 T -1637725680 87 T -1637725680 90 T -1637725680 101 T -1637725680 102 T -1637725680 103 T -1637725680 109 STOP ********** Program terminated normally. STOP ********** Program terminated normally. T -1637725680 114 T -1637725680 117 T -1637725680 118 T -1637725680 119 T -1637725680 124 T -1637725680 125 T -1637725680 131 T -1637725680 134 T -1637725680 135 T -1637725680 136 T -1637725680 137 T -1637725680 140 T -1637725680 149 T -1637725680 160 T -1637725680 161 T -1637725680 163 T -1637725680 165 T -1637725680 166 T -1637725680 174 T -1637725680 176 T -1637725680 177 T -1637725680 179 T -1637725680 182 T -1637725680 184 T -1637725680 185 T -1637725680 188 T -1637725680 195 T -1637725680 19 T -1637725680 56 T -1637725680 61 T -1637725680 111 T -1637725680 133 T -1637725680 141 T -1637725680 142 T -1637725680 144 T -1637725680 147 T -1637725680 151 T -1637725680 156 T -1637725680 158 T -1637725680 162 T -1637725680 164 T -1637725680 170 T -1637725680 171 T -1637725680 172 T -1637725680 173 T -1637725680 178 T -1637725680 189 T -1637725680 191 T -1637725680 192 T -1637725680 196 T -1637725680 197 T -1637725680 199 T -1637725680 201 T -1637725680 202 T -1637725680 204 T -1637725680 154 T -1637725680 159 T -1637725680 186 T -1637725680 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
