Tuesday, September 24 2024 01:17:44
UNRES
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CTEST_FULL_OUTPUT STOP ********** Program terminated normally. STOP ********** Program terminated normally. T 1281348752 1 T 1281348752 4 T 1281348752 9 T 1281348752 12 T 1281348752 15 T 1281348752 26 T 1281348752 33 T 1281348752 37 T 1281348752 38 T 1281348752 50 T 1281348752 53 T 1281348752 2 T 1281348752 7 T 1281348752 11 T 1281348752 14 T 1281348752 19 T 1281348752 24 T 1281348752 25 T 1281348752 28 T 1281348752 42 T 1281348752 43 T 1281348752 45 T 1281348752 47 T 1281348752 3 T 1281348752 5 T 1281348752 13 T 1281348752 16 T 1281348752 35 T 1281348752 48 T 1281348752 6 T 1281348752 10 T 1281348752 17 T 1281348752 20 T 1281348752 21 T 1281348752 22 T 1281348752 23 T 1281348752 29 T 1281348752 30 T 1281348752 32 T 1281348752 34 T 1281348752 39 T 1281348752 40 T 1281348752 41 T 1281348752 44 T 1281348752 46 T 1281348752 51 T 1281348752 52 T 1281348752 8 T 1281348752 18 T 1281348752 27 T 1281348752 31 T 1281348752 36 T 1281348752 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
