Monday, September 23 2024 06:23:58
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1.21s
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CTEST_FULL_OUTPUT STOP ********** Program terminated normally.STOP ********** Program terminated normally. T -1457379536 1 T -1457379536 4 T -1457379536 9 T -1457379536 12 T -1457379536 15 T -1457379536 26 T -1457379536 33 T -1457379536 37 T -1457379536 38 T -1457379536 50 T -1457379536 53 T -1457379536 2 T -1457379536 7 T -1457379536 11 T -1457379536 14 T -1457379536 19 T -1457379536 24 T -1457379536 25 T -1457379536 28 T -1457379536 42 T -1457379536 43 T -1457379536 45 T -1457379536 47 T -1457379536 3 T -1457379536 5 T -1457379536 13 T -1457379536 16 T -1457379536 35 T -1457379536 48 T -1457379536 6 T -1457379536 10 T -1457379536 17 T -1457379536 20 T -1457379536 21 T -1457379536 22 T -1457379536 23 T -1457379536 29 T -1457379536 30 T -1457379536 32 T -1457379536 34 T -1457379536 39 T -1457379536 40 T -1457379536 41 T -1457379536 44 T -1457379536 46 T -1457379536 51 T -1457379536 52 T -1457379536 8 T -1457379536 18 T -1457379536 27 T -1457379536 31 T -1457379536 36 T -1457379536 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
