Monday, November 04 2024 22:25:40
UNRES
5.56s
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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 2139
# eval/s 397.129384949436
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 ]
8.657073974609375E-002 order[ 1 ] 0.204525947570801 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 ] 1.21125268936157 order[
8 ] 0.000000000000000E+000 order[ 9 ]
0.000000000000000E+000 order[ 10 ] 0.000000000000000E+000
Total wall clock time 5.43739008903503 sec
Processor 0 BROADCAST time 5.755424499511719E-003 REDUCE time
4.019904136657715E-002 GATHER time 0.000000000000000E+000 SCATTER time
0.000000000000000E+000 SENDRECV 0.000000000000000E+000 BARRIER ene
3.298521041870117E-003 BARRIER grad 2.868890762329102E-003
CG processor 0 is finishing work.
SUMSL return code 4
OK: absdiff= 1.0924, ene= -3.226007E+02
