Monday, November 04 2024 22:24:53
UNRES
26.53s| Exit Value | 1 |
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CTEST_FULL_OUTPUT CTEST_FULL_OUTPUT MPI: node= 0 iseed= -3059742 indpdb= 0 pdbref= T ns= 0 Call Read_Bridge. ns= 0 Total wall clock time 26.477295875549316 sec Processor 0 BROADCAST time 0.18286371231079102 REDUCE time 1.2289953231811523 GATHER time 0.0000000000000000 SCATTER time 0.11249685287475586 SENDRECV 0.0000000000000000 BARRIER ene 0.10606908798217773 BARRIER grad 0.12155771255493164 CG processor 0 is finishing work. Processor 1 CG group 0 absolute rank 1 leves ERGASTULUM. Processor 1 wait times for respective orders order[ 0 ] 0.52602982521057129 order[ 1 ] 0.11042642593383789 order[ 2 ] 0.0000000000000000 order[ 3 ] 0.0000000000000000 order[ 4 ] 2.3639430999755859 order[ 5 ] 0.0000000000000000 order[ 6 ] 0.0000000000000000 order[ 7 ] 0.62454462051391602 order[ 8 ] 2.3344876082964707E-310 order[ 9 ] 2.0595683258875225E-316 order[ 10 ] 6.9531864357451198E-310 STOP Bye Bye... STOP Bye Bye... average total energy 74.3154 standard deviation 0.0598498 average total energy 74.3154 standard deviation 0.0598498 difference 36.7884 from reference ave etot 37.527 greater than 5.0 difference 36.7884 from reference ave etot 37.527 greater than 5.0
