Friday, September 20 2024 06:31:42
UNRES
5.65s
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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 395.170827780869
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 ]
8.392333984375000E-002 order[ 1 ] 0.206834793090820 order[
Total wall clock time 5.47605800628662 sec
Processor 0 BROADCAST time 6.369352340698242E-003 REDUCE time
4.463791847229004E-002 GATHER time 0.000000000000000E+000 SCATTER time
0.000000000000000E+000 SENDRECV 0.000000000000000E+000 BARRIER ene
3.477096557617188E-003 BARRIER grad 4.709005355834961E-003
CG processor 0 is finishing work.
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 ] 1.21193695068359 order[
8 ] 0.000000000000000E+000 order[ 9 ]
0.000000000000000E+000 order[ 10 ] 0.000000000000000E+000
SUMSL return code 4
OK: absdiff= 1.092400, ene= -322.600700
