Wednesday, September 25 2024 01:24:25
UNRES
89.66s| Temperature distribution 1DKZcut-ber |
|---|
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CTEST_FULL_OUTPUT
[dell15:111910] [[5524,0],0] ORTE_ERROR_LOG: Data unpack would read past end of buffer in file ../../orte/util/show_help.c at line 507
[dell15:111910] [[5524,0],0] ORTE_ERROR_LOG: Data unpack would read past end of buffer in file ../../orte/util/show_help.c at line 507
Warning: ieee_invalid is signaling
Warning: ieee_divide_by_zero is signaling
Warning: ieee_inexact is signaling
Warning: ieee_invalid is signaling
Warning: ieee_divide_by_zero is signaling
Warning: ieee_inexact is signaling
Bye Bye...
Bye Bye...
thetname_pdb
/tmp/cdash/source/PARAM/thetaml.5parm
51 opened
thetname_pdb
/tmp/cdash/source/PARAM/thetaml.5parm
51 opened
ns= 0
MPI: node= 0 iseed= -3059742
indpdb= 19 pdbref= T
Call Read_Bridge.
ns= 0
Processor 1 CG group 0 absolute rank 1
leves ERGASTULUM.
Total wall clock time 88.30149756406900 sec
Processor 1 wait times for respective orders order[ 0 ]
0.000000000000000 order[ 1 ] 0.3802580144256353
order[ 2 ] 1.667464598198421 order[ 3 ]
0.7561235236935318 order[ 4 ] 3.056519101723097
order[ 5 ] 0.000000000000000 order[ 6 ]
0.000000000000000 order[ 7 ] 4.115140704787336
order[ 8 ] 0.000000000000000 order[ 9 ]
0.000000000000000 order[ 10 ] 0.000000000000000
Processor 0 BROADCAST time 0.7637309051351622 REDUCE time
2.562975110020489 GATHER time 0.000000000000000 SCATTER time
0.5619627517880872 SENDRECV 0.000000000000000 BARRIER ene
1.552261231816374 BARRIER grad 0.1876421162160113
CG processor 0 is finishing work.
Chi2 for fitting theoretical temperature distribution 0.0031388606
