Execution Time0.75s

Test: UNRES_ss_static_min (Failed)
Build: homology Linux-pgi-MPI E0LL2Y (dell15) on 2018-01-20 04:21:30
Repository revision: 1845eb441493e1443732fcc6da5fa41873470995

Exit Value2

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Test output
CTEST_FULL_OUTPUT
Warning: ieee_invalid is signaling
Warning: ieee_divide_by_zero is signaling
Warning: ieee_overflow is signaling
Warning: ieee_inexact is signaling
Bye Bye...
Warning: ieee_invalid is signaling
Warning: ieee_divide_by_zero is signaling
Warning: ieee_overflow is signaling
Warning: ieee_inexact is signaling
Bye Bye...
[dell15:113073] 1 more process has sent help message help-mpi-common-cuda.txt / dlopen failed
[dell15:113073] Set MCA parameter "orte_base_help_aggregate" to 0 to see all help / error messages
--------------------------------------------------------------------------
The library attempted to open the following supporting CUDA libraries, 
but each of them failed.  CUDA-aware support is disabled.
libcuda.so.1: cannot open shared object file: No such file or directory
/usr/lib64/libcuda.so.1: cannot open shared object file: No such file or directory
If you are not interested in CUDA-aware support, then run with 
--mca mpi_cuda_support 0 to suppress this message.  If you are interested
in CUDA-aware support, then try setting LD_LIBRARY_PATH to the location
of libcuda.so.1 to get passed this issue.
--------------------------------------------------------------------------
 nodes            2  rank            0
 nodes            2  rank            1
 Processor            0  out of            2  rank in CG_COMM            0 
 Processor            1  out of            2  rank in CG_COMM            1 
  size of CG_COMM            2  size of FG_COMM            1  rank in FG_COMM1 
  size of CG_COMM            2  size of FG_COMM            1  rank in FG_COMM1 
            0  size of FG_COMM1            1
            0  size of FG_COMM1            1
Inside initializeInside initialize thetname_pdb 
 /tmp/cdash/homology/source/PARAM/thetaml.5parm                                                                                                                                                                                                                  
 thetname_pdb 
 /tmp/cdash/homology/source/PARAM/thetaml.5parm                                                                                                                                                                                                                  
           51  opened
           51  opened
 MPI: node=             1  iseed=                  -2222665
 MPI: node=             0  iseed=                  -1111332
 indpdb=           25  pdbref=  T
 indpdb=           25  pdbref=  T
 Call Read_Bridge.
 ns=            4
 Call Read_Bridge.
 ns=            4
 Processor            1            0            0  ivec_start            1 
  ivec_end           39
 Processor            0            0            0  ivec_start            1 
  ivec_end           39
 SUMSL return code is            8  eval           226
 # eval/s    1186.171945701358     
 refstr=  T
 SUMSL return code is            8  eval           226
 # eval/s    1181.551520016553     
 refstr=  T
CG processor   1 is finishing work.
CG processor   0 is finishing work.
initial energy=134.838 reference=134.8382
SUMSL return code 16
ERROR = SUMSL return code 16 is not 4
but not failing this test, it is known problem with dissulfides
CRITICAL: energy is loo large 16.170900, ene= -135.150900