Execution Time1.78s

Test: UNRES_M_DOCK_cluster (Passed)
Build: devel Linux-ifort-MPI-5D-DFA NEWCORR (dell15) on 2020-05-04 04:28:43
Repository revision: 2bc0c5f06a45a86998d13adb237a1c84e46e12e8


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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   7.41875E+01 AVE RMSD 9.09
wham_T280K_0001.pdb:REMARK 2wfu UNRES-Dock      ENERGY     7.67990E+01 RMS    9.35
wham_T280K_0002.pdb:REMARK CLUSTER    2 FREE ENERGY   7.45644E+01 AVE RMSD 9.29
wham_T280K_0002.pdb:REMARK 2wfu UNRES-Dock      ENERGY     7.68007E+01 RMS    9.24
wham_T280K_0003.pdb:REMARK CLUSTER    3 FREE ENERGY   7.46104E+01 AVE RMSD 7.47
wham_T280K_0003.pdb:REMARK 2wfu UNRES-Dock      ENERGY     7.68079E+01 RMS    8.37
wham_T280K_0004.pdb:REMARK CLUSTER    4 FREE ENERGY   7.49647E+01 AVE RMSD10.35
wham_T280K_0004.pdb:REMARK 2wfu UNRES-Dock      ENERGY     7.68075E+01 RMS   10.32
wham_T280K_0005.pdb:REMARK CLUSTER    5 FREE ENERGY   7.51834E+01 AVE RMSD 7.47
wham_T280K_0005.pdb:REMARK 2wfu UNRES-Dock      ENERGY     7.68545E+01 RMS    7.49