Wednesday, September 25 2024 07:25:00
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0.38s
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CTEST_FULL_OUTPUT STOP ********** Program terminated normally. STOP ********** Program terminated normally. T 1632139616 1 T 1632139616 4 T 1632139616 9 T 1632139616 12 T 1632139616 15 T 1632139616 26 T 1632139616 33 T 1632139616 37 T 1632139616 38 T 1632139616 50 T 1632139616 53 T 1632139616 2 T 1632139616 7 T 1632139616 11 T 1632139616 14 T 1632139616 19 T 1632139616 24 T 1632139616 25 T 1632139616 28 T 1632139616 42 T 1632139616 43 T 1632139616 45 T 1632139616 47 T 1632139616 3 T 1632139616 5 T 1632139616 13 T 1632139616 16 T 1632139616 35 T 1632139616 48 T 1632139616 6 T 1632139616 10 T 1632139616 17 T 1632139616 20 T 1632139616 21 T 1632139616 22 T 1632139616 23 T 1632139616 29 T 1632139616 30 T 1632139616 32 T 1632139616 34 T 1632139616 39 T 1632139616 40 T 1632139616 41 T 1632139616 44 T 1632139616 46 T 1632139616 51 T 1632139616 52 T 1632139616 8 T 1632139616 18 T 1632139616 27 T 1632139616 31 T 1632139616 36 T 1632139616 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
