Tuesday, September 17 2024 20:48:51
UNRES
41.45s| Temperature distribution 1L2Y_B | File /tmp/cdash/homology/build/source/unres/src_MD/1L2Y_B_GB000.stat.png not found |
|---|---|
| Processors | [Graph]1 |
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CTEST_FULL_OUTPUT
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_INVALID_FLAG IEEE_DIVIDE_BY_ZERO IEEE_DENORMAL
STOP Bye Bye...
nodes 2 rank 1
nodes 2 rank 0
Processor 1 out of 2 rank in FG_COMM 1 size of FG_COMM 2 rank in FG_COMM1 1 size of FG_COMM1 2
Processor 0 out of 2 rank in CG_COMM 0 size of CG_COMM 1 size of FG_COMM 2 rank in FG_COMM1 0 size of FG_COMM1 2
Inside initializeInside initialize MPI: node= 0 iseed= -3059742
indpdb= 0 pdbref= T
ns= 0
Processor 1 1 1 ivec_start 11 ivec_end 21
Call Read_Bridge.
ns= 0
Processor 0 0 0 ivec_start 1 ivec_end 10
Total wall clock time 41.365264892578125 sec
Processor 0 BROADCAST time 0.30769014358520508 REDUCE time 3.1173498630523682 GATHER time 0.0000000000000000 SCATTER time 0.40512728691101074 SENDRECV 0.0000000000000000 BARRIER ene 1.7624871730804443 BARRIER grad 0.55208349227905273
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 ] 9.8813129168249309E-324 order[ 1 ] 0.56671118736267090 order[ 2 ] 1.7483105659484863 order[ 3 ] 1.1555218696594238 order[ 4 ] 4.2638831138610840 order[ 5 ] 1.0133286396203967E-320 order[ 6 ] 0.0000000000000000 order[ 7 ] 1.5447585582733154 order[ 8 ] 0.0000000000000000 order[ 9 ] 0.0000000000000000 order[ 10 ] 0.0000000000000000 order[ 11 ] 0.0000000000000000 order[ 12 ] 4.6561769917847079E-310
File "./matplotlib_fit_hist.py", line 44
print '%15.10f' % chi_squared
^
SyntaxError: Missing parentheses in call to 'print'. Did you mean print('%15.10f' % chi_squared)?
Chi2 for fitting theoretical temperature distribution
(standard_in) 1: syntax error
./prota_unres_energy_check.sh: line 98: [: !=: unary operator expected
