0.44s
Test: UNRES_M_REGULAR
(Passed)
Build: homology Linux-pgi-MPI E0LL2Y
(dell15)
on 2024-02-14 04:25:19
Repository revision: e5301131661f6c05ad36e8aceadd77d37334772a
Show Command Line/opt/pgi/linux86-64/2019/mpi/openmpi-3.1.3/bin/mpirun "-np" "1" "/tmp/cdash/homology/build/source/unres/src_MD-M/test_prota_E0LL2Y.sh" "1l2y_MIN_REGULAR_INT" "1"
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Test outputCTEST_FULL_OUTPUT
MPI: node= 0 iseed= -3059742
indpdb= 33 pdbref= T
Call Read_Bridge.
ns= 0
Enter REGULARIZE: nnt= 2 nct= 21 nsup= 20
nstart_seq= 2 nstart_sup 2
Enter REGULARIZE: Initial RMS deviation: 0.00000
Regularization: pass: 1
Etot= 10.89923614167545
Regularization: pass: 2
Etot= 10.89923614167545
Final minimization ...
Etot= 10.89923614167545
CG processor 0 is finishing work.
Warning: ieee_invalid is signaling
Warning: ieee_denorm is signaling
Warning: ieee_divide_by_zero is signaling
Warning: ieee_underflow is signaling
Warning: ieee_inexact is signaling
Bye Bye...
SUMSL return code 3
WARNING = SUMSL return code 3 is not 4
OK: absdiff= 3.342792, ene= 9.892792