Friday, September 20 2024 08:48:08
UNRES
15.32s
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CTEST_FULL_OUTPUT
CTEST_FULL_OUTPUT
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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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nodes 2 rank 1
nodes 2 rank 0
Processor 0 out of 2 rank in CG_COMM 0
size of CG_COMM 1 size of FG_COMM 2 rank in FG_COMM1
Processor 1 out of 2 rank in FG_COMM 1
size of FG_COMM 2 rank in FG_COMM1 1 size of FG_COMM1
0 size of FG_COMM1 2
2
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= 0 iseed= -3059742
indpdb= 0 pdbref= T
ns= 0
Call Read_Bridge.
ns= 0
Processor 1 1 1 ivec_start 11
ivec_end 21
Processor 0 0 0 ivec_start 1
ivec_end 10
[dell15:75821] 1 more process has sent help message help-mpi-common-cuda.txt / dlopen failed
[dell15:75821] Set MCA parameter "orte_base_help_aggregate" to 0 to see all help / error messages
Processor 1 CG group 0 absolute rank 1
leves ERGASTULUM.
Total wall clock time 15.17851781845093 sec
Processor 0 BROADCAST time 0.2269527912139893 REDUCE time
0.5596120357513428 GATHER time 0.000000000000000 SCATTER time
6.8029403686523438E-002 SENDRECV 0.000000000000000 BARRIER ene
9.3451023101806641E-002 BARRIER grad 7.7160835266113281E-002
CG processor 0 is finishing work.
Processor 1 wait times for respective orders order[ 0 ]
0.4068317413330078 order[ 1 ] 0.1101989746093750
order[ 2 ] 0.000000000000000 order[ 3 ]
0.000000000000000 order[ 4 ] 1.378250360488892
order[ 5 ] 0.000000000000000 order[ 6 ]
0.000000000000000 order[ 7 ] 0.3895552158355713
order[ 8 ] 0.000000000000000 order[ 9 ]
0.000000000000000 order[ 10 ] 0.000000000000000
order[ 11 ] 0.000000000000000 order[ 12 ]
0.000000000000000
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...
average total energy 74.2967
standard deviation 0.0294284
average total energy 74.2967
standard deviation 0.0294284
