Tuesday, September 17 2024 21:45:33
UNRES
9.58s
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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 8 eval 2232
# eval/s 238.45680342307261
refstr= T
after hairpin
after secondary
Processor 1 CG group 0 absolute rank 1 leves ERGASTULUM.
Total wall clock time 9.4973468780517578 sec
Processor 1 wait times for respective orders order[ 0 ] 9.1409206390380859E-002 order[ 1 ] 0.42866921424865723 order[ 2 ] 6.0134700169990685E-154 order[ 3 ] 6.0134700169990685E-154 order[ 4 ] 6.0134700169990685E-154 order[ 5 ] 6.0134700169990685E-154 order[ 6 ] 6.9530240935066166E-310 order[ 7 ] 2.0325288772583008 order[ 8 ] 6.9530240935066166E-310 order[ 9 ] 2.3280170697081402E-310 order[ 10 ] 6.0134700169990685E-154
Processor 0 BROADCAST time 5.3708553314208984E-003 REDUCE time 4.3595314025878906E-002 GATHER time 0.0000000000000000 SCATTER time 0.0000000000000000 SENDRECV 0.0000000000000000 BARRIER ene 4.8673152923583984E-003 BARRIER grad 2.6569366455078125E-003
CG processor 0 is finishing work.
SUMSL return code 23
ERROR = SUMSL return code 23 is not 4
but not failing this test, it is known problem with esccor
OK: absdiff= .343700, ene= -323.349400
