0.33s
Test: UNRES_M_REGULAR
(Passed)
Build: devel Linux-ifort-MPI NEWCORR
(dell15)
on 2020-03-31 05:04:42
Repository revision: df5ad6c769f328b01ef15673420b789f998f0d83
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= 82.3278039306078
Regularization: pass: 2
Etot= 80.8551098102108
Final minimization ...
Etot= 80.8485565688380
CG processor 0 is finishing work.
Bye Bye...
SUMSL return code 8
WARNING = SUMSL return code 8 is not 4
OK: absdiff= .417930, ene= 80.848570