Execution Time2.43s

Test: UNRES_M_DOCK_cluster (Passed)
Build: devel Linux-ifort-MPI-DFA NEWCORR (dell15) on 2020-04-22 04:02:04
Repository revision: c8f1285550b0dbec11ec40fe6caab6f400bf21d2


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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   9.05476E+01 AVE RMSD 3.01
wham_T280K_0001.pdb:REMARK 2wfu UNRES-Dock      ENERGY     9.32634E+01 RMS    3.73
wham_T280K_0002.pdb:REMARK CLUSTER    2 FREE ENERGY   9.06575E+01 AVE RMSD 7.72
wham_T280K_0002.pdb:REMARK 2wfu UNRES-Dock      ENERGY     9.32641E+01 RMS    6.81
wham_T280K_0003.pdb:REMARK CLUSTER    3 FREE ENERGY   9.06614E+01 AVE RMSD 8.80
wham_T280K_0003.pdb:REMARK 2wfu UNRES-Dock      ENERGY     9.32659E+01 RMS    8.42
wham_T280K_0004.pdb:REMARK CLUSTER    4 FREE ENERGY   9.11256E+01 AVE RMSD 9.43
wham_T280K_0004.pdb:REMARK 2wfu UNRES-Dock      ENERGY     9.32644E+01 RMS    9.45
wham_T280K_0005.pdb:REMARK CLUSTER    5 FREE ENERGY   9.13354E+01 AVE RMSD 7.43
wham_T280K_0005.pdb:REMARK 2wfu UNRES-Dock      ENERGY     9.32644E+01 RMS    7.38