Execution Time1.20s

Test: UNRES_M_DOCK_cluster (Passed)
Build: devel Linux-ifort-MPI-DFA E0LL2Y (dell15) on 2020-04-08 04:20:35
Repository revision: 7c5373260289072f6022e1d937ab775fc820e6a2


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Test output
CTEST_FULL_OUTPUT
wrong number of coordinates in xdr3dfcoor; 165082110 arg vs 97 in file********** Program terminated normally.
********** Program terminated normally.
 JESTEM
THERE ARE    5 FAMILIES OF CONFORMATIONS
wham_T280K_0001.pdb:REMARK CLUSTER    1 FREE ENERGY  -1.49689E+02 AVE RMSD 1.37
wham_T280K_0001.pdb:REMARK 2wfu UNRES-Dock      ENERGY    -1.47001E+02 RMS    1.35
wham_T280K_0002.pdb:REMARK CLUSTER    2 FREE ENERGY  -1.49297E+02 AVE RMSD 2.75
wham_T280K_0002.pdb:REMARK 2wfu UNRES-Dock      ENERGY    -1.46999E+02 RMS    2.95
wham_T280K_0003.pdb:REMARK CLUSTER    3 FREE ENERGY  -1.48995E+02 AVE RMSD 3.47
wham_T280K_0003.pdb:REMARK 2wfu UNRES-Dock      ENERGY    -1.46996E+02 RMS    3.88
wham_T280K_0004.pdb:REMARK CLUSTER    4 FREE ENERGY  -1.48664E+02 AVE RMSD 3.75
wham_T280K_0004.pdb:REMARK 2wfu UNRES-Dock      ENERGY    -1.46989E+02 RMS    4.27
wham_T280K_0005.pdb:REMARK CLUSTER    5 FREE ENERGY  -1.46524E+02 AVE RMSD 8.90
wham_T280K_0005.pdb:REMARK 2wfu UNRES-Dock      ENERGY    -1.46006E+02 RMS    9.06