Tuesday, September 24 2024 06:26:37
UNRES
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CTEST_FULL_OUTPUT STOP ********** Program terminated normally. STOP ********** Program terminated normally. T 227215536 1 T 227215536 4 T 227215536 9 T 227215536 12 T 227215536 15 T 227215536 26 T 227215536 33 T 227215536 37 T 227215536 38 T 227215536 50 T 227215536 53 T 227215536 2 T 227215536 7 T 227215536 11 T 227215536 14 T 227215536 19 T 227215536 24 T 227215536 25 T 227215536 28 T 227215536 42 T 227215536 43 T 227215536 45 T 227215536 47 T 227215536 3 T 227215536 5 T 227215536 13 T 227215536 16 T 227215536 35 T 227215536 48 T 227215536 6 T 227215536 10 T 227215536 17 T 227215536 20 T 227215536 21 T 227215536 22 T 227215536 23 T 227215536 29 T 227215536 30 T 227215536 32 T 227215536 34 T 227215536 39 T 227215536 40 T 227215536 41 T 227215536 44 T 227215536 46 T 227215536 51 T 227215536 52 T 227215536 8 T 227215536 18 T 227215536 27 T 227215536 31 T 227215536 36 T 227215536 49 THERE ARE 5 FAMILIES OF CONFORMATIONS 1L2Y_wham_T280K_0001.pdb:REMARK CLUSTER 1 FREE ENERGY 4.88719E+00 AVE RMSD 3.28 1L2Y_wham_T280K_0001.pdb:REMARK 1L2Y clustering ENERGY 5.00998E+00 RMS 3.22 1L2Y_wham_T280K_0002.pdb:REMARK CLUSTER 2 FREE ENERGY 5.51604E+00 AVE RMSD 3.73 1L2Y_wham_T280K_0002.pdb:REMARK 1L2Y clustering ENERGY 5.86048E+00 RMS 3.93 1L2Y_wham_T280K_0003.pdb:REMARK CLUSTER 3 FREE ENERGY 5.59557E+00 AVE RMSD 4.73 1L2Y_wham_T280K_0003.pdb:REMARK 1L2Y clustering ENERGY 5.95984E+00 RMS 4.54 1L2Y_wham_T280K_0004.pdb:REMARK CLUSTER 4 FREE ENERGY 5.79408E+00 AVE RMSD 2.24 1L2Y_wham_T280K_0004.pdb:REMARK 1L2Y clustering ENERGY 6.38056E+00 RMS 2.19 1L2Y_wham_T280K_0005.pdb:REMARK CLUSTER 5 FREE ENERGY 6.35101E+00 AVE RMSD 4.09 1L2Y_wham_T280K_0005.pdb:REMARK 1L2Y clustering ENERGY 6.63064E+00 RMS 3.96
