CTEST_FULL_OUTPUT
STOP ********** Program terminated normally.
STOP ********** Program terminated normally.
T 24441440 1
T 24441440 4
T 24441440 9
T 24441440 12
T 24441440 15
T 24441440 26
T 24441440 33
T 24441440 37
T 24441440 38
T 24441440 50
T 24441440 53
T 24441440 2
T 24441440 7
T 24441440 11
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T 24441440 19
T 24441440 24
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T 24441440 28
T 24441440 42
T 24441440 43
T 24441440 45
T 24441440 47
T 24441440 3
T 24441440 5
T 24441440 13
T 24441440 16
T 24441440 35
T 24441440 48
T 24441440 6
T 24441440 10
T 24441440 17
T 24441440 20
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T 24441440 22
T 24441440 23
T 24441440 29
T 24441440 30
T 24441440 32
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T 24441440 46
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T 24441440 8
T 24441440 18
T 24441440 27
T 24441440 31
T 24441440 36
T 24441440 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