381.74s
Test: UNRES_CSA_local_E0LL2Y
(Passed)
Build: homology Linux-ifort-MPI E0LL2Y
(dell15)
on 2020-04-30 04:20:35
Repository revision: a41c0a93eccae628b3f98c627c8a1291022a903d
Show Command Line/users/local/mpich-3.3.1_intel/bin/mpiexec "-np" "4" "/tmp/cdash/homology/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 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
Processor 0 out of 4 rank in CG_COMM 0
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
size of CG_COMM 4 size of FG_COMM 1 rank in FG_COMM1
0 size of FG_COMM1 1
Inside initializeInside initializeInside initializeInside initialize thetname_pdb
/tmp/cdash/homology/source/PARAM/thetaml.5parm
51 opened
thetname_pdb
/tmp/cdash/homology/source/PARAM/thetaml.5parm
thetname_pdb
51 opened
/tmp/cdash/homology/source/PARAM/thetaml.5parm
thetname_pdb
51 opened
/tmp/cdash/homology/source/PARAM/thetaml.5parm
51 opened
MPI: node= 1 iseed= -6119485
MPI: node= 2 iseed= -9179228
MPI: node= 3 iseed= -12238971
indpdb= 0 pdbref= F
indpdb= 0 pdbref= F
Call Read_Bridge.
ns= 0
Call Read_Bridge.
ns= 0
Processor 2 0 0 ivec_start 1 ivec_end
21
MPI: node= 0 iseed= -3059742
Processor 1 0 0 ivec_start 1 ivec_end
21
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
UPDATING 100 100
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UPDATING 100 100
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UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
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UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
End of cycle, master time for 35 iters 120.327398061752
End of minim, proc 1 time 120.341621875763
End of minim, proc 2 time 120.341683149338
End of minim, proc 3 time 120.341685056686
sec, Eval/s 10404.9037888900
UPDATING 3 4
Exitted from make_ranvar nconfr= 100
FEEDIN: NCONF= 100
UPDATING 97 97
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
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UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
End of minim, proc 2 time 205.014413118362
End of minim, proc 3 time 205.014462947845
End of cycle, master time for 20 iters 76.0077409744263
End of minim, proc 1 time 205.044387817383
sec, Eval/s 11204.6219119516
UPDATING 3 4
Exitted from make_ranvar nconfr= 100
FEEDIN: NCONF= 100
UPDATING 97 97
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
UPDATING 100 100
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UPDATING 100 100
UPDATING 100 100
End of minim, proc 1 time 373.588210821152
End of minim, proc 2 time 373.588205099106
End of cycle, master time for 55 iters 161.420726060867
sec, Eval/s 12227.2836219046
UPDATING 3 4
End of minim, proc 3 time 373.607169866562
End of RUN, master time 373.617084026337 sec, Eval/s
11329.4337464012
CG processor 0 is finishing work.
CG processor 3 is finishing work.
CG processor 2 is finishing work.
CG processor 1 is finishing work.
Bye Bye...
Bye Bye...
Bye Bye...
Bye Bye...
Emin= 31.50622
Emin= 31.50622
Emin= 31.50622
Emin= 31.50622
difference .02055 from reference emin 31.52677
difference .02055 from reference emin 31.52677
difference .02055 from reference emin 31.52677
difference .02055 from reference emin 31.52677
grep: 1l2y_csa_local_4P*.pdb: No such file or directory
grep: 1l2y_csa_local_4P*.pdb: No such file or directory
grep: 1l2y_csa_local_4P*.pdb: No such file or directory
grep: 1l2y_csa_local_4P*.pdb: No such file or directory