Execution Time1.96s

Test: UNRES_M_DOCK_cluster (Passed)
Build: devel Linux-ifort-MPI-DFA NEWCORR (dell15) on 2020-04-13 04:29:45
Repository revision: 5673961eec8f29bcff4be10a73b31f835ac927db


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Test output
CTEST_FULL_OUTPUT
wrong number of coordinates in xdr3dfcoor; 3 arg vs 97 in file********** Program terminated normally.
********** Program terminated normally.
THERE ARE    5 FAMILIES OF CONFORMATIONS
wham_T280K_0001.pdb:REMARK CLUSTER    1 FREE ENERGY   7.69956E+01 AVE RMSD 1.35
wham_T280K_0001.pdb:REMARK 2wfu UNRES-Dock      ENERGY     7.99678E+01 RMS    1.45
wham_T280K_0002.pdb:REMARK CLUSTER    2 FREE ENERGY   7.73610E+01 AVE RMSD 1.40
wham_T280K_0002.pdb:REMARK 2wfu UNRES-Dock      ENERGY     7.99693E+01 RMS    1.28
wham_T280K_0003.pdb:REMARK CLUSTER    3 FREE ENERGY   7.74762E+01 AVE RMSD 1.20
wham_T280K_0003.pdb:REMARK 2wfu UNRES-Dock      ENERGY     7.99694E+01 RMS    1.06
wham_T280K_0004.pdb:REMARK CLUSTER    4 FREE ENERGY   7.88832E+01 AVE RMSD 2.32
wham_T280K_0004.pdb:REMARK 2wfu UNRES-Dock      ENERGY     7.99877E+01 RMS    2.64
wham_T280K_0005.pdb:REMARK CLUSTER    5 FREE ENERGY   7.96087E+01 AVE RMSD 4.23
wham_T280K_0005.pdb:REMARK 2wfu UNRES-Dock      ENERGY     8.03560E+01 RMS    4.73