Saturday, September 21 2024 02:42:44
UNRES
49.89s| Temperature distribution 1DKZcut-lang |
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CTEST_FULL_OUTPUT
[dell15:48321] 1 more process has sent help message help-mpi-common-cuda.txt / dlopen failed
[dell15:48321] Set MCA parameter "orte_base_help_aggregate" to 0 to see all help / error messages
Warning: ieee_invalid is signaling
Warning: ieee_divide_by_zero is signaling
Warning: ieee_inexact is signaling
Bye Bye...
Warning: ieee_invalid is signaling
Warning: ieee_divide_by_zero is signaling
Warning: ieee_inexact is signaling
Bye Bye...
--------------------------------------------------------------------------
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.
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thetname_pdb
/tmp/cdash/source/PARAM/thetaml.5parm
thetname_pdb
/tmp/cdash/source/PARAM/thetaml.5parm
51 opened
51 opened
MPI: node= 0 iseed= -3059742
indpdb= 19 pdbref= T
ns= 0
Call Read_Bridge.
ns= 0
Total wall clock time 49.33652305603027 sec
Processor 0 BROADCAST time 0.1262319087982178 REDUCE time
0.8606374263763428 GATHER time 0.000000000000000 SCATTER time
0.1282894611358643 SENDRECV 0.000000000000000 BARRIER ene
Processor 1 CG group 0 absolute rank 1
leves ERGASTULUM.
5.9399604797363281E-002 BARRIER grad 4.1241407394409180E-002
CG processor 0 is finishing work.
Processor 1 wait times for respective orders order[ 0 ]
0.000000000000000 order[ 1 ] 6.4713478088378906E-002
order[ 2 ] 0.3690061569213867 order[ 3 ]
0.3806099891662598 order[ 4 ] 3.590613126754761
order[ 5 ] 0.000000000000000 order[ 6 ]
0.000000000000000 order[ 7 ] 7.0735454559326172E-002
order[ 8 ] 0.000000000000000 order[ 9 ]
2.530044555664063 order[ 10 ] 3.9529800415039063E-003
Chi2 for fitting theoretical temperature distribution 0.0000214175
