97.44s
Test: UNRES_remd_dfa
(Passed)
Build: devel Linux-ifort-MPI-DFA_no5D E0LL2Y
(dell15)
on 2023-05-29 04:56:29
Repository revision: 3d79e89922e83ded1dd9fe7689d30b45567bd6ef
| Histograms remd_dfa |  |
|---|
| Energy remd_dfa |  |
|---|
Show Command Line/bin/sh "/tmp/cdash/devel/build/source/unres/src_MD-M-SAXS-homology/dfa/test_mpi_E0LL2Y.sh" "remd_dfa" "1" "8"
Show Test Time Graph
Show Failing/Passing Graph
Test outputCTEST_FULL_OUTPUT
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1
1
1
1
1
1
1
1
indpdb= 45 pdbref= T
indpdb= 45 pdbref= T
indpdb= 45 pdbref= T
indpdb= 45 pdbref= T
indpdb= 45 pdbref= T
indpdb= 45 pdbref= T
indpdb= 45 pdbref= T
indpdb= 45 pdbref= T
Call Read_Bridge.
Call Read_Bridge.
Call Read_Bridge.
Call Read_Bridge.
Call Read_Bridge.
Call Read_Bridge.
Call Read_Bridge.
Call Read_Bridge.
ishiftca= 1 ilastca= 76
init_dfa_vars finished!
ishiftca= 1 ilastca= 76
init_dfa_vars finished!
ishiftca= 1 ilastca= 76
init_dfa_vars finished!
ishiftca= 1 ilastca= 76
init_dfa_vars finished!
ishiftca= 1 ilastca= 76
init_dfa_vars finished!
ishiftca= 1 ilastca= 76
init_dfa_vars finished!
ishiftca= 1 ilastca= 76
init_dfa_vars finished!
ishiftca= 1 ilastca= 76
init_dfa_vars finished!
read_dfa_info finished!
read_dfa_info finished!
read_dfa_info finished!
read_dfa_info finished!
ns= 0
read_dfa_info finished!
ns= 0
ns= 0
ns= 0
ns= 0
read_dfa_info finished!
ns= 0
read_dfa_info finished!
ns= 0
read_dfa_info finished!
ns= 0
Processor 4 rest F restart1fie T
Processor 1 rest F restart1fie T
Processor 5 rest F restart1fie T
Processor 6 rest F restart1fie T
Processor 2 rest F restart1fie T
Processor 0 rest F restart1fie T
Processor 3 rest F restart1fie T
Processor 7 rest F restart1fie T
SC_move 670 124.547565673304
SC_move 670 82.0662467696093
SC_move 670 144.355741380146
SC_move 670 105.310864867078
SC_move 670 88.5854083432199
SC_move 670 124.547565673304
SC_move 670 85.6262719103616
SC_move 670 106.702014940560
CG processor 0 is finishing work.
CG processor 1 is finishing work.
CG processor 2 is finishing work.
CG processor 3 is finishing work.
CG processor 4 is finishing work.
CG processor 5 is finishing work.
CG processor 6 is finishing work.
CG processor 7 is finishing work.
/usr/lib/pymodules/python2.7/matplotlib/axes.py:2760: UserWarning: Attempting to set identical bottom==top results
in singular transformations; automatically expanding.
bottom=0, top=0
+ 'bottom=%s, top=%s') % (bottom, top))
ACC 1 240.00000 0.03030 99
ACC 2 260.00000 0.02020 99
ACC 3 280.00000 0.22222 99
ACC 4 300.00000 0.13131 99
ACC 5 320.00000 0.07071 99
ACC 6 340.00000 0.41414 99
ACC 7 360.00000 0.01010 99
average exchange = 0.128426
