0.38s
Test: UNRES_M_REGULAR
(Failed)
Build: devel Linux-ifort-MPI-5D-DFA NEWCORR
(dell15)
on 2020-04-05 04:31:12
Repository revision: f2129863e0bb6c820119c51c77185b744f615b84
Show Command Line/users/local/mpich-3.3.1_intel/bin/mpiexec "-np" "1" "/tmp/cdash/devel/build/source/unres/src-HCD-5D/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= 34.4008335975901
Regularization: pass: 2
Etot= 33.7066292958181
Final minimization ...
Etot= 29.7722321735657
CG processor 0 is finishing work.
Bye Bye...
SUMSL return code
WARNING = SUMSL return code is not 4
CRITICAL: energy is loo large 51.494270, ene= 29.772230