16.67s
Test: UNRES_MD_microcanonical
(Passed)
Build: Linux-gfortan-MPI E0LL2Y
(m10)
on 2024-01-12 03:08:05
Repository revision: cfd3f3ea9ccac7a6b9cb0e802b4c9e5927a506f6
Show Command Line/users2/local/mpich3.2_gnu/bin/mpiexec "-np" "2" "/tmp/cdash/build/source/unres/src_MD/test_prota_E0LL2Y.sh" "1l2y_micro" "2"
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Show Failing/Passing Graph
Test outputCTEST_FULL_OUTPUT
CTEST_FULL_OUTPUT
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 initialize 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
Inside initialize MPI: node= 0 iseed= -3059742
indpdb= 0 pdbref= T
ns= 0
Processor 1 1 1 ivec_start 11 ivec_end 21
Call Read_Bridge.
ns= 0
Processor 0 0 0 ivec_start 1 ivec_end 10
Processor 1 CG group 0 absolute rank 1 leves ERGASTULUM.
Total wall clock time 16.515715837478638 sec
Processor 1 wait times for respective orders order[ 0 ] 0.14971303939819336 order[ 1 ] 7.1050167083740234E-002 order[ 2 ] 0.0000000000000000 order[ 3 ] 0.0000000000000000 order[ 4 ] 1.9624485969543457 order[ 5 ] 0.0000000000000000 order[ 6 ] 4.6454930899050350E-310 order[ 7 ] 0.41358089447021484 order[ 8 ] 0.0000000000000000 order[ 9 ] 0.0000000000000000 order[ 10 ] 0.0000000000000000
Processor 0 BROADCAST time 0.15771102905273438 REDUCE time 0.48542118072509766 GATHER time 0.0000000000000000 SCATTER time 7.8373193740844727E-002 SENDRECV 0.0000000000000000 BARRIER ene 9.8961591720581055E-002 BARRIER grad 7.4798583984375000E-002
CG processor 0 is finishing work.
Note: The following floating-point exceptions are signalling: IEEE_INVALID_FLAG IEEE_DIVIDE_BY_ZERO
STOP Bye Bye...
Note: The following floating-point exceptions are signalling: IEEE_INVALID_FLAG IEEE_DIVIDE_BY_ZERO IEEE_DENORMAL
STOP Bye Bye...
average total energy 74.254
average total energy 74.254
standard deviation 0.0141421
standard deviation 0.0141421