Friday, September 20 2024 18:31:44
UNRES
5.86s
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2
2
indpdb= 25 pdbref= T
Call Read_Bridge.
ns= 0
ns= 0
after etotal
after hairpin
after secondary
Calling MINIM_DC
SUMSL return code is 4 eval 2139
# eval/s 385.812147203521
refstr= T
after hairpin
after secondary
Processor 1 CG group 0 absolute rank 1
leves ERGASTULUM.
Processor 1 wait times for respective orders order[ 0 ]
Total wall clock time 5.61401200294495 sec
Processor 0 BROADCAST time 7.680654525756836E-003 REDUCE time
5.275774002075195E-002 GATHER time 0.000000000000000E+000 SCATTER time
0.000000000000000E+000 SENDRECV 0.000000000000000E+000 BARRIER ene
8.694052696228027E-002 order[ 1 ] 0.206340789794922 order[
2 ] 0.000000000000000E+000 order[ 3 ]
0.000000000000000E+000 order[ 4 ] 0.000000000000000E+000 order[
5 ] 0.000000000000000E+000 order[ 6 ]
0.000000000000000E+000 order[ 7 ] 1.21369147300720 order[
8 ] 0.000000000000000E+000 order[ 9 ]
0.000000000000000E+000 order[ 10 ] 0.000000000000000E+000
5.375385284423828E-003 BARRIER grad 4.109621047973633E-003
CG processor 0 is finishing work.
SUMSL return code 4
OK: absdiff= 1.0924, ene= -3.226007E+02
