0.88s
Test: UNRES_M_MIN_prota
(Passed)
Build: devel Linux-gfortan-MPI E0LL2Y
(m10)
on 2020-03-29 03:00:26
Repository revision: b3efc8d5acc9051f49c246721f0d1f78dde46d01
Show Command Line/users2/local/mpich3.2_gnu/bin/mpiexec "-np" "2" "/tmp/cdash/devel/build/source/unres/src_MD-M-SAXS-homology/test_prota_E0LL2Y.sh" "prota_MIN_CART" "2"
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Test outputCTEST_FULL_OUTPUT
CTEST_FULL_OUTPUT
2
2
indpdb= 25 pdbref= T
0.0000000000000000 0.0000000000000000
45 46 47
1.9750000000000014 -2.0169999999999995
45 46 47
-0.87200000000000000 -3.2160000000000002
45 46 47
3.1690000000000000 0.43400000000000016
0.0000000000000000 0.0000000000000000
2 3 4
0.91500000000000004 -1.5520000000000000
2 3 4
3.3159999999999998 2.1159999999999997
2 3 4
-1.5579999999999998 2.7590000000000003
0.0000000000000000 0.0000000000000000
45 46 47
1.9750000000000014 -2.0169999999999995
45 46 47
-0.87200000000000000 -3.2160000000000002
45 46 47
3.1690000000000000 0.43400000000000016
0.0000000000000000 0.0000000000000000
2 3 4
0.91500000000000004 -1.5520000000000000
2 3 4
3.3159999999999998 2.1159999999999997
2 3 4
-1.5579999999999998 2.7590000000000003
ns= 0
Call Read_Bridge.
ns= 0
after etotal
after hairpin
after secondary
Calling MINIM_DC
SUMSL return code is 8 eval 1085
# eval/s 1464.7456871010695
refstr= T
after hairpin
after secondary
Total wall clock time 0.77798795700073242 sec
Processor 0 BROADCAST time 2.5596618652343750E-003 REDUCE time 9.4347000122070312E-003 GATHER time 0.0000000000000000 SCATTER time 0.0000000000000000 SENDRECV 0.0000000000000000 BARRIER ene 2.0649433135986328E-003 BARRIER grad 8.1634521484375000E-004
Processor 1 CG group 0 absolute rank 1 leves ERGASTULUM.
Processor 1 wait times for respective orders order[ 0 ] 5.3265094757080078E-003 order[ 1 ] 4.6390056610107422E-002 order[ 2 ] 6.0134700169990685E-154 order[ 3 ] 6.0134700169990685E-154 order[ 4 ] 6.0134700169990685E-154 order[ 5 ] 1.1477459029171256E-310 order[ 6 ] 6.0134700169990685E-154 order[ 7 ] 0.20503211021423340 order[ 8 ] 4.9406564584124654E-324 order[ 9 ] 1.1477459029776487E-310 order[ 10 ] 4.6453627794577499E-310
CG processor 0 is finishing work.
Note: The following floating-point exceptions are signalling: IEEE_DIVIDE_BY_ZERO IEEE_DENORMAL
STOP Bye Bye...
Note: The following floating-point exceptions are signalling: IEEE_DIVIDE_BY_ZERO IEEE_DENORMAL
STOP Bye Bye...
SUMSL return code 8
ERROR = SUMSL return code 8 is not 4
SUMSL return code 8
ERROR = SUMSL return code 8 is not 4
OK: absdiff= .086000, ene= -158.646100
OK: absdiff= .086000, ene= -158.646100