Saturday, September 21 2024 22:06:31
UNRES
1.83s
Show Command Line
Show Test Time Graph
Show Failing/Passing Graph
CTEST_FULL_OUTPUT wrong number of coordinates in xdr3dfcoor; 3 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 -1.61800E+02 AVE RMSD 1.42 wham_T280K_0001.pdb:REMARK 2wfu UNRES-Dock ENERGY -1.59008E+02 RMS 1.05 wham_T280K_0002.pdb:REMARK CLUSTER 2 FREE ENERGY -1.61569E+02 AVE RMSD 1.54 wham_T280K_0002.pdb:REMARK 2wfu UNRES-Dock ENERGY -1.59010E+02 RMS 1.66 wham_T280K_0003.pdb:REMARK CLUSTER 3 FREE ENERGY -1.61168E+02 AVE RMSD 1.37 wham_T280K_0003.pdb:REMARK 2wfu UNRES-Dock ENERGY -1.59008E+02 RMS 1.22 wham_T280K_0004.pdb:REMARK CLUSTER 4 FREE ENERGY -1.60844E+02 AVE RMSD 1.40 wham_T280K_0004.pdb:REMARK 2wfu UNRES-Dock ENERGY -1.59007E+02 RMS 1.31 wham_T280K_0005.pdb:REMARK CLUSTER 5 FREE ENERGY -1.59898E+02 AVE RMSD 2.60 wham_T280K_0005.pdb:REMARK 2wfu UNRES-Dock ENERGY -1.58999E+02 RMS 2.72
