1.14s
Test: UNRES_M_MIN_prota
(Failed)
Build: devel Linux-gfortan-MPI NEWCORR
(dell15)
on 2020-03-20 22:16:35
Repository revision: 01df9c4e865c1c5c100a7132ed5a0819a5b52410
Show Command Line/users/local/mpich2-1.4.1p1_gnu/bin/mpiexec "-np" "2" "/tmp/cdash/devel/build/source/unres/src_MD-M-SAXS-homology/test_prota_E0LL2Y.sh" "prota_MIN_CART" "2"
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Show Failing/Passing Graph
Test outputCTEST_FULL_OUTPUT
CTEST_FULL_OUTPUT
2
2
indpdb= 25 pdbref= T
0.0000000000000000 0.0000000000000000
45 46 47
1.9750000000000014 -2.0169999999999995
45 46 47
-0.87200000000000000 -3.2160000000000002
45 46 47
3.1690000000000000 0.43400000000000016
0.0000000000000000 0.0000000000000000
2 3 4
0.91500000000000004 -1.5520000000000000
2 3 4
3.3159999999999998 2.1159999999999997
2 3 4
-1.5579999999999998 2.7590000000000003
Call Read_Bridge.
ns= 0
0.0000000000000000 0.0000000000000000
45 46 47
1.9750000000000014 -2.0169999999999995
45 46 47
-0.87200000000000000 -3.2160000000000002
45 46 47
3.1690000000000000 0.43400000000000016
0.0000000000000000 0.0000000000000000
2 3 4
0.91500000000000004 -1.5520000000000000
2 3 4
3.3159999999999998 2.1159999999999997
2 3 4
-1.5579999999999998 2.7590000000000003
ns= 0
after etotal
after hairpin
after secondary
Calling MINIM_DC
SUMSL return code is 4 eval 887
# eval/s 909.16831287325567
refstr= T
after hairpin
after secondary
Processor 1 CG group 0 absolute rank 1 leves ERGASTULUM.
Total wall clock time 1.0617430210113525 sec
Processor 1 wait times for respective orders order[ 0 ] 2.1343946456909180E-002 order[ 1 ] 5.9913158416748047E-002 order[ 2 ] 6.0134700169990685E-154 order[ 3 ] 6.0134700169990685E-154 order[ 4 ] 6.0134700169990685E-154 order[ 5 ] 6.0134700169990685E-154 order[ 6 ] 6.9526444849628157E-310 order[ 7 ] 0.29030394554138184 order[ 8 ] 6.9526444849628157E-310 order[ 9 ] 2.3647969223366441E-310 order[ 10 ] 6.0134700169990685E-154
Processor 0 BROADCAST time 1.7077922821044922E-003 REDUCE time 9.2337131500244141E-003 GATHER time 0.0000000000000000 SCATTER time 0.0000000000000000 SENDRECV 0.0000000000000000 BARRIER ene 1.2659549713134766E-002 BARRIER grad 8.2302093505859375E-004
CG processor 0 is finishing work.
STOP Bye Bye...
STOP Bye Bye...
SUMSL return code 4
SUMSL return code 4
CRITICAL: energy is loo large 228.736130, ene= 70.004030
CRITICAL: energy is loo large 228.736130, ene= 70.004030