0.45s
Test: UNRES_M_REGULAR
(Passed)
Build: devel Linux-pgi-MPI E0LL2Y
(dell15)
on 2020-03-20 20:29:10
Repository revision: 97bbeb6bd9b6c571c253b9d758e7408642e4343e
Show Command Line/opt/pgi/linux86-64/2019/mpi/openmpi-3.1.3/bin/mpirun "-np" "1" "/tmp/cdash/devel/build/source/unres/src_MD-M-SAXS-homology/test_prota_E0LL2Y.sh" "1l2y_MIN_REGULAR_INT" "1"
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Test outputCTEST_FULL_OUTPUT
1
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= 0.4537243666584487
Regularization: pass: 2
Etot= -5.574686894702111
Final minimization ...
Etot= -5.813328837075147
CG processor 0 is finishing work.
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 8
WARNING = SUMSL return code 8 is not 4
OK: absdiff= 2.462584, ene= -6.975916