1.32s
Test: UNRES_M_MIN_prota
(Failed)
Build: homology Linux-gfortan-MPI E0LL2Y
(dell15)
on 2019-10-20 03:25:05
Repository revision: 855057911aaa7d3d083c300f4a9b1e7323f5d7da
Show Command Line/users/local/mpich2-1.4.1p1_gnu/bin/mpiexec "-np" "2" "/tmp/cdash/homology/build/source/unres/src_MD-M/test_prota_E0LL2Y.sh" "prota_MIN_CART" "2"
Show Test Time Graph
Show Failing/Passing Graph
Test outputCTEST_FULL_OUTPUT
CTEST_FULL_OUTPUT
MPI: node= 0 iseed= -3059742
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
just before leave
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
just before leave
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
just before leave
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
just before leave
ns= 0
Call Read_Bridge.
ns= 0
dc -1.8521036991148909
dc -1.8521036991148909 -0.27399709316174381 1.2579789626266946
after etotal
after hairpin
after secondary
Calling MINIM_DC
SUMSL return code is 8 eval 901
# eval/s 794.33852254008036
refstr= T
after hairpin
after secondary
Processor 1 CG group 0 absolute rank 1 leves ERGASTULUM.
Total wall clock time 1.1981348991394043 sec
Processor 0 BROADCAST time 2.0418167114257812E-003 REDUCE time 1.0917425155639648E-002 GATHER time 0.0000000000000000 SCATTER time 0.0000000000000000 SENDRECV 0.0000000000000000 BARRIER ene 1.3089179992675781E-003 BARRIER grad 1.2326240539550781E-003
Processor 1 wait times for respective orders order[ 0 ] 1.2737035751342773E-002 order[ 1 ] 5.4065227508544922E-002 order[ 2 ] 2.3619423334398854E-310 order[ 3 ] 2.3619423241031316E-310 order[ 4 ] 0.0000000000000000 order[ 5 ] 6.9530562977393931E-310 order[ 6 ] 2.3619431658136226E-310 order[ 7 ] 0.26482796669006348 order[ 8 ] 2.3619431668440459E-310 order[ 9 ] 2.0595683258875225E-316 order[ 10 ] 6.9530562977520412E-310
CG processor 0 is finishing work.
STOP Bye Bye...
STOP Bye Bye...
SUMSL return code 8
ERROR = SUMSL return code 8 is not 4
SUMSL return code 8
ERROR = SUMSL return code 8 is not 4
WARNING: energy is somewhat different .756300, ene= -159.488400
WARNING: energy is somewhat different .756300, ene= -159.488400