9.20s
Test: UNRES_MD_microcanonical
(Passed)
Build: homology Linux-gfortan-MPI E0LL2Y
(m10)
on 2023-05-20 03:27:09
Repository revision: e5301131661f6c05ad36e8aceadd77d37334772a
Show Command Line/users2/local/mpich3.2_gnu/bin/mpiexec "-np" "2" "/tmp/cdash/homology/build/source/unres/src_MD/test_prota_E0LL2Y.sh" "1l2y_micro" "2"
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Test outputCTEST_FULL_OUTPUT
CTEST_FULL_OUTPUT
nodes 2 rank 1
nodes 2 rank 0
Processor 1 out of 2 rank in FG_COMM 1 size of FG_COMM 2 rank in FG_COMM1 1 size of FG_COMM1 2
Processor 0 out of 2 rank in CG_COMM 0 size of CG_COMM 1 size of FG_COMM 2 rank in FG_COMM1 0 size of FG_COMM1 2
Inside initializeInside initialize ns= 0
Processor 1 1 1 ivec_start 11 ivec_end 21
MPI: node= 0 iseed= -3059742
indpdb= 0 pdbref= T
Call Read_Bridge.
ns= 0
Processor 0 0 0 ivec_start 1 ivec_end 10
Total wall clock time 9.0234429836273193 sec
Processor 0 BROADCAST time 0.13701438903808594 REDUCE time 0.46458745002746582 GATHER time 0.0000000000000000 SCATTER time 5.6725263595581055E-002 SENDRECV 0.0000000000000000 BARRIER ene 5.8652400970458984E-002 BARRIER grad 7.3864459991455078E-002
CG processor 0 is finishing work.
Processor 1 CG group 0 absolute rank 1 leves ERGASTULUM.
Processor 1 wait times for respective orders order[ 0 ] 0.19638371467590332 order[ 1 ] 8.0684900283813477E-002 order[ 2 ] 0.0000000000000000 order[ 3 ] 0.0000000000000000 order[ 4 ] 1.1562840938568115 order[ 5 ] 1.2142157312194475E-319 order[ 6 ] 0.0000000000000000 order[ 7 ] 0.24843478202819824 order[ 8 ] 4.9406564584124654E-324 order[ 9 ] 0.0000000000000000 order[ 10 ] 0.0000000000000000 order[ 11 ] 0.0000000000000000 order[ 12 ] 0.0000000000000000
Note: The following floating-point exceptions are signalling: IEEE_INVALID_FLAG IEEE_DIVIDE_BY_ZERO IEEE_DENORMAL
STOP Bye Bye...
Note: The following floating-point exceptions are signalling: IEEE_INVALID_FLAG IEEE_DIVIDE_BY_ZERO
STOP Bye Bye...
average total energy 74.082
standard deviation 0.293287
average total energy 74.082
standard deviation 0.293287