CTEST_FULL_OUTPUT
STOP Bye Bye...
STOP Bye Bye...
2
2
indpdb= 25 pdbref= T
ns= 0
Call Read_Bridge.
ns= 0
after etotal
after hairpin
after secondary
Calling MINIM_DC
SUMSL return code is 4 eval 2652
# eval/s 271.62282489545498
refstr= T
after hairpin
after secondary
Processor 1 CG group 0 absolute rank 1 leves ERGASTULUM.
Total wall clock time 9.8394930362701416 sec
Processor 0 BROADCAST time 7.9674720764160156E-003 REDUCE time 6.5483331680297852E-002 GATHER time 0.0000000000000000 SCATTER time 0.0000000000000000 SENDRECV 0.0000000000000000 BARRIER ene 5.2063465118408203E-003 BARRIER grad 2.7592182159423828E-003
CG processor 0 is finishing work.
Processor 1 wait times for respective orders order[ 0 ] 0.11668467521667480 order[ 1 ] 0.53094172477722168 order[ 2 ] 6.0134700169990685E-154 order[ 3 ] 6.0134700169990685E-154 order[ 4 ] 6.0134700169990685E-154 order[ 5 ] 6.0134700169990685E-154 order[ 6 ] 6.9532087532223523E-310 order[ 7 ] 2.4530112743377686 order[ 8 ] 6.9532087532223523E-310 order[ 9 ] 2.3315007448977115E-310 order[ 10 ] 6.0134700169990685E-154
SUMSL return code 21
ERROR = SUMSL return code 21 is not 4
but not failing this test, it is known problem with esccor
CRITICAL: energy is loo large 432.853600, ene= 109.160500