413.85s
Test: UNRES_CSA_local_E0LL2Y
(Passed)
Build: Linux-ifort-MPI E0LL2Y
(dell15)
on 2023-05-13 03:52:16
Repository revision: cfd3f3ea9ccac7a6b9cb0e802b4c9e5927a506f6
Show Command Line/users/local/mpich2-1.4.1p1_intel/bin/mpiexec "-np" "4" "/tmp/cdash/build/source/unres/src_CSA/test_csa_E0LL2Y.sh" "1l2y_csa_local"
Show Test Time Graph
Show Failing/Passing Graph
Test outputCTEST_FULL_OUTPUT
CTEST_FULL_OUTPUT
CTEST_FULL_OUTPUT
CTEST_FULL_OUTPUT
Processor 1 out of 4 rank in CG_COMM 1
size of CG_COMM 4 size of FG_COMM 1 rank in FG_COMM1
0 size of FG_COMM1 1
Processor 2 out of 4 rank in CG_COMM 2
size of CG_COMM 4 size of FG_COMM 1 rank in FG_COMM1
0 size of FG_COMM1 1
Processor 3 out of 4 rank in CG_COMM 3
size of CG_COMM 4 size of FG_COMM 1 rank in FG_COMM1
0 size of FG_COMM1 1
Inside initializeInside initializeInside initialize thetname_pdb
/tmp/cdash/source/PARAM/thetaml.5parm
51 opened
thetname_pdb
/tmp/cdash/source/PARAM/thetaml.5parm
51 opened
thetname_pdb
Processor 0 out of 4 rank in CG_COMM 0
size of CG_COMM 4 size of FG_COMM 1 rank in FG_COMM1
0 size of FG_COMM1 1
Inside initialize thetname_pdb
/tmp/cdash/source/PARAM/thetaml.5parm
51 opened
MPI: node= 2 iseed= -9179228
MPI: node= 1 iseed= -6119485
indpdb= 0 pdbref= F
Call Read_Bridge.
ns= 0
indpdb= 0 pdbref= F
Processor 2 0 0 ivec_start 1 ivec_end
21
Call Read_Bridge.
ns= 0
Processor 1 0 0 ivec_start 1 ivec_end
21
/tmp/cdash/source/PARAM/thetaml.5parm
51 opened
MPI: node= 0 iseed= -3059742
MPI: node= 3 iseed= -12238971
indpdb= 0 pdbref= F
Call Read_Bridge.
ns= 0
Processor 3 0 0 ivec_start 1 ivec_end
21
indpdb= 0 pdbref= F
Call Read_Bridge.
ns= 0
Processor 0 0 0 ivec_start 1 ivec_end
21
Exitted from make_ranvar nconfr= 100
FEEDIN: NCONF= 100
UPDATING 97 97
UPDATING 100 100
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UPDATING 100 100
UPDATING 100 100
End of minim, proc 2 time 111.897812843323
End of minim, proc 1 time 111.900259017944
End of cycle, master time for 34 iters 111.929976940155
End of minim, proc 3 time 111.942065000534
sec, Eval/s 11250.4266901911
UPDATING 3 4
Exitted from make_ranvar nconfr= 100
FEEDIN: NCONF= 100
UPDATING 97 97
UPDATING 100 100
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End of minim, proc 3 time 291.415409088135
End of minim, proc 2 time 291.415575981140
End of cycle, master time for 50 iters 172.609764814377
End of minim, proc 1 time 291.452733039856
sec, Eval/s 10472.3159894454
UPDATING 3 4
Exitted from make_ranvar nconfr= 100
FEEDIN: NCONF= 100
UPDATING 97 97
UPDATING 100 100
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UPDATING 100 100
End of minim, proc 1 time 406.610849142075
End of cycle, master time for 26 iters 105.128293991089
sec, Eval/s 9413.23179927073
End of minim, proc 2 time 406.610977888107
End of minim, proc 3 time 406.611021041870
UPDATING 3 4
End of RUN, master time 406.625952959061 sec, Eval/s
10353.3184966771
CG processor 0 is finishing work.
CG processor 1 is finishing work.
CG processor 2 is finishing work.
CG processor 3 is finishing work.
Bye Bye...
Bye Bye...
Bye Bye...
Bye Bye...
Emin= 31.52678
Emin= 31.52678
Emin= 31.52678
Emin= 31.52678
difference .00001 from reference emin 31.52677
difference .00001 from reference emin 31.52677
difference .00001 from reference emin 31.52677
difference .00001 from reference emin 31.52677
grep: 1l2y_csa_local_4P*.pdb: No such file or directory
grep: grep: 1l2y_csa_local_4P*.pdb1l2y_csa_local_4P*.pdb: No such file or directory
: No such file or directory
grep: 1l2y_csa_local_4P*.pdb: No such file or directory