Tuesday, September 17 2024 21:37:44
UNRES
0.15s| Exit Value | 1 |
|---|---|
| Processors | [Graph]1 |
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CTEST_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 4 eval 2
# eval/s 490.67664950865702
refstr= T
after hairpin
after secondary
Total wall clock time 4.9864053726196289E-002 sec
Processor 0 BROADCAST time 1.0728836059570312E-005 REDUCE time 3.8146972656250000E-005 GATHER time 0.0000000000000000 SCATTER time 0.0000000000000000 SENDRECV 0.0000000000000000 BARRIER ene 1.3828277587890625E-005 BARRIER grad 9.5367431640625000E-007
CG processor 0 is finishing work.
Processor 1 CG group 0 absolute rank 1 leves ERGASTULUM.
Processor 1 wait times for respective orders order[ 0 ] 1.1205673217773438E-004 order[ 1 ] 6.0134700169990685E-154 order[ 2 ] 6.0134700169990685E-154 order[ 3 ] 6.0134700169990685E-154 order[ 4 ] 6.0134700169990685E-154 order[ 5 ] 1.1229754913929624E-310 order[ 6 ] 6.0134700169990685E-154 order[ 7 ] 9.5295906066894531E-004 order[ 8 ] 4.9406564584124654E-324 order[ 9 ] 1.1229754914534855E-310 order[ 10 ] 4.6367039154642792E-310
Note: The following floating-point exceptions are signalling: IEEE_INVALID_FLAG 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 4
SUMSL return code 4
(standard_in) 1: illegal character: \
(standard_in) 1: syntax error
(standard_in) 1: illegal character: \
(standard_in) 1: syntax error
(standard_in) 1: syntax error
./prota_unres_energy_check_mult.sh: line 315: [: -eq: unary operator expected
(standard_in) 1: syntax error
WARNING: energy is somewhat different , ene= 10000000000000000000000000000000000000000000000000000000000000000000\
00000000000000000000000000000000.000000
./prota_unres_energy_check_mult.sh: line 322: [: -eq: unary operator expected
(standard_in) 1: syntax error
./prota_unres_energy_check_mult.sh: line 315: [: -eq: unary operator expected
(standard_in) 1: syntax error
WARNING: energy is somewhat different , ene= 10000000000000000000000000000000000000000000000000000000000000000000\
00000000000000000000000000000000.000000
./prota_unres_energy_check_mult.sh: line 322: [: -eq: unary operator expected
