CTEST_FULL_OUTPUT
STOP ********** Program terminated normally.
STOP ********** Program terminated normally.
T -225206640 1
T -225206640 4
T -225206640 9
T -225206640 11
T -225206640 15
T -225206640 26
T -225206640 33
T -225206640 37
T -225206640 38
T -225206640 50
T -225206640 53
T -225206640 2
T -225206640 8
T -225206640 12
T -225206640 14
T -225206640 19
T -225206640 24
T -225206640 25
T -225206640 28
T -225206640 41
T -225206640 43
T -225206640 46
T -225206640 47
T -225206640 3
T -225206640 5
T -225206640 13
T -225206640 16
T -225206640 35
T -225206640 48
T -225206640 6
T -225206640 10
T -225206640 17
T -225206640 20
T -225206640 21
T -225206640 22
T -225206640 23
T -225206640 29
T -225206640 30
T -225206640 31
T -225206640 34
T -225206640 39
T -225206640 40
T -225206640 42
T -225206640 44
T -225206640 45
T -225206640 51
T -225206640 52
T -225206640 7
T -225206640 18
T -225206640 27
T -225206640 32
T -225206640 36
T -225206640 49
THERE ARE 5 FAMILIES OF CONFORMATIONS
1L2Y_wham_T280K_0001.pdb:REMARK CLUSTER 1 FREE ENERGY 4.87926E+00 AVE RMSD 3.28
1L2Y_wham_T280K_0001.pdb:REMARK 1L2Y clustering ENERGY 5.00239E+00 RMS 3.22
1L2Y_wham_T280K_0002.pdb:REMARK CLUSTER 2 FREE ENERGY 5.50972E+00 AVE RMSD 3.73
1L2Y_wham_T280K_0002.pdb:REMARK 1L2Y clustering ENERGY 5.85452E+00 RMS 3.93
1L2Y_wham_T280K_0003.pdb:REMARK CLUSTER 3 FREE ENERGY 5.58551E+00 AVE RMSD 4.72
1L2Y_wham_T280K_0003.pdb:REMARK 1L2Y clustering ENERGY 5.94537E+00 RMS 4.54
1L2Y_wham_T280K_0004.pdb:REMARK CLUSTER 4 FREE ENERGY 5.78127E+00 AVE RMSD 2.24
1L2Y_wham_T280K_0004.pdb:REMARK 1L2Y clustering ENERGY 6.36579E+00 RMS 2.19
1L2Y_wham_T280K_0005.pdb:REMARK CLUSTER 5 FREE ENERGY 6.34186E+00 AVE RMSD 4.09
1L2Y_wham_T280K_0005.pdb:REMARK 1L2Y clustering ENERGY 6.61895E+00 RMS 3.96