Tuesday, November 05 2024 07:57:27
UNRES
1.64s| Processors | [Graph]1 |
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CTEST_FULL_OUTPUT Note: The following floating-point exceptions are signalling: IEEE_INVALID_FLAG IEEE_DIVIDE_BY_ZERO IEEE_OVERFLOW_FLAG STOP Bye Bye... Note: The following floating-point exceptions are signalling: IEEE_INVALID_FLAG IEEE_DIVIDE_BY_ZERO IEEE_OVERFLOW_FLAG STOP Bye Bye... nodes 1 rank 0 Processor 0 out of 1 rank in CG_COMM 0 size of CG_COMM 1 size of FG_COMM 1 rank in FG_COMM1 0 size of FG_COMM1 1 Inside initialize nodes 1 rank 0 Processor 0 out of 1 rank in CG_COMM 0 size of CG_COMM 1 size of FG_COMM 1 rank in FG_COMM1 0 size of FG_COMM1 1 Inside initialize MPI: node= 0 iseed= -1111332 indpdb= 25 pdbref= T Call Read_Bridge. ns= 4 Processor 0 0 0 ivec_start 1 ivec_end 39 MPI: node= 0 iseed= -1111332 indpdb= 25 pdbref= T Call Read_Bridge. ns= 4 Processor 0 0 0 ivec_start 1 ivec_end 39 SUMSL return code is 8 eval 1472 # eval/s 1891.5771275397447 refstr= T SUMSL return code is 8 eval 1472 # eval/s 1901.8089182140588 refstr= T CG processor 0 is finishing work. CG processor 0 is finishing work. initial energy=134.838 reference=134.8382 SUMSL return code 8 ERROR = SUMSL return code 8 is not 4 but not failing this test, it is known problem with dissulfides OK: absdiff= 3.562400, ene= -147.759400
