Sunday, September 22 2024 22:27:10
UNRES
47.20s| Temperature distribution 1DKZcut-ber |
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CTEST_FULL_OUTPUT
[dell15:110751] 1 more process has sent help message help-mpi-common-cuda.txt / dlopen failed
[dell15:110751] 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
51 opened
thetname_pdb
/tmp/cdash/source/PARAM/thetaml.5parm
51 opened
MPI: node= 0 iseed= -3059742
indpdb= 19 pdbref= T
Call Read_Bridge.
ns= 0
ns= 0
Total wall clock time 46.62182593345642 sec
Processor 0 BROADCAST time 8.4353446960449219E-002 REDUCE time
0.5764710903167725 GATHER time 0.000000000000000 SCATTER time
4.8427820205688477E-002 SENDRECV 0.000000000000000 BARRIER ene
0.1442224979400635 BARRIER grad 4.6072244644165039E-002
Processor 1 CG group 0 absolute rank 1
leves ERGASTULUM.
CG processor 0 is finishing work.
Processor 1 wait times for respective orders order[ 0 ]
0.000000000000000 order[ 1 ] 7.0993661880493164E-002
order[ 2 ] 0.2804360389709473 order[ 3 ]
0.4395823478698730 order[ 4 ] 2.212412595748901
order[ 5 ] 0.000000000000000 order[ 6 ]
0.000000000000000 order[ 7 ] 2.454035282135010
order[ 8 ] 0.000000000000000 order[ 9 ]
0.000000000000000 order[ 10 ] 0.000000000000000
Chi2 for fitting theoretical temperature distribution 0.0032407153
