Saturday, September 21 2024 07:31:12
UNRES
8.44s| Exit Value | 1 |
|---|
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CTEST_FULL_OUTPUT STOP Bye Bye... STOP Bye Bye... MPI: node= 0 iseed= -3059742 indpdb= 25 pdbref= T Call Read_Bridge. ns= 0 ns= 0 dc 65.917000000000002 dc 65.917000000000002 122.68350000000001 48.083500000000001 after etotal after hairpin after secondary Calling MINIM_DC SUMSL return code is 4 eval 1663 # eval/s 200.83074029838266 refstr= T after hairpin after secondary Processor 1 CG group 0 absolute rank 1 leves ERGASTULUM. Total wall clock time 8.3934359550476074 sec Processor 0 BROADCAST time 4.2510032653808594E-003 REDUCE time 3.9927005767822266E-002 GATHER time 0.0000000000000000 SCATTER time 0.0000000000000000 SENDRECV 0.0000000000000000 BARRIER ene 1.1482477188110352E-002 BARRIER grad 6.6916942596435547E-003 Processor 1 wait times for respective orders order[ 0 ] 1.8131494522094727E-002 order[ 1 ] 0.33776450157165527 order[ 2 ] 0.0000000000000000 order[ 3 ] 0.0000000000000000 order[ 4 ] 0.0000000000000000 order[ 5 ] 0.0000000000000000 order[ 6 ] 0.0000000000000000 order[ 7 ] 1.5279779434204102 order[ 8 ] 2.3650588219473640E-310 order[ 9 ] 2.0595683258875225E-316 order[ 10 ] 6.9532721843738845E-310 CG processor 0 is finishing work. SUMSL return code 23 ERROR = SUMSL return code 23 is not 4 but not failing this test, it is known problem with esccor WARNING: energy is somewhat different 4.319100, ene= -319.374000
