0.67s
Test: UNRES_M_ENE1_prota
(Passed)
Build: homology Linux-ifort-MPI E0LL2Y
(dell15)
on 2024-11-02 03:52:58
Show Command Line/opt/intel/intelpython3/bin/mpiexec "-np" "1" "/tmp/cdash/homology/build/source/unres/src_MD-M/test_prota_E0LL2Y.sh" "prota_ENE_m" "1"
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Test outputCTEST_FULL_OUTPUT
MPI: node= 0 iseed= -3059742
indpdb= 23 pdbref= T
0.000000000000000E+000 0.000000000000000E+000
45 46 47
1.97500000000000 -2.01700000000000
45 46 47
-0.872000000000000 -3.21600000000000
45 46 47
3.16900000000000 0.434000000000000
just before leave
0.000000000000000E+000 0.000000000000000E+000
2 3 4
0.915000000000000 -1.55200000000000
2 3 4
3.31600000000000 2.11600000000000
2 3 4
-1.55800000000000 2.75900000000000
just before leave
Call Read_Bridge.
ns= 0
dc -1.85210369911489
dc -1.85210369911489 -0.273997093161744 1.25797896262669
after etotal
after hairpin
after secondary
refstr= T
CG processor 0 is finishing work.
Bye Bye...
OK: absdiff= 0, ene= -146.009100