Execution Time19.69s

Test: UNRES_M_CHECKGRAD_homology (Failed)
Build: devel Linux-ifort-MPI-DFA NEWCORR (dell15) on 2020-04-10 04:27:35
Repository revision: fb796f6ccc7879c3ae3d07e87499aaa430469deb

Exit Value1

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Test output
CTEST_FULL_OUTPUT
Bye Bye...
Bye Bye...
 2  
 2  
    
    
 indpdb=          57  pdbref= T
 ns=           0
 Call Read_Bridge.
 ns=           0
Calling CHECK_ECARTINT   1.000D-04
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 Processor           1  CG group           0  absolute rank           1 
  leves ERGASTULUM.
 Processor           1  wait times for respective orders order[           0 ]
  1.205682754516602E-003  order[           1 ]  0.000000000000000E+000  order[
           2 ]  0.000000000000000E+000  order[           3 ]
  0.000000000000000E+000  order[           4 ]  0.000000000000000E+000  order[
           5 ]  0.000000000000000E+000  order[           6 ]
  0.000000000000000E+000  order[           7 ]  7.351636886596680E-003  order[
           8 ]  0.000000000000000E+000  order[           9 ]
 Total wall clock time   19.4738478660583       sec
 Processor           0  BROADCAST time  6.803989410400391E-003  REDUCE time
  0.000000000000000E+000  order[          10 ]  0.000000000000000E+000
  3.968238830566406E-003  GATHER time  0.000000000000000E+000  SCATTER time
  0.000000000000000E+000  SENDRECV  0.000000000000000E+000  BARRIER ene
  0.349679946899414       BARRIER grad  2.145767211914062E-006
CG processor   0 is finishing work.
Largest abs(1-numerical/analytical)=  1
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ETOT=  999999999999999967336168804116691273849533185806555472917961779471295845921727862608739868455469056  reference=  3812.23
difference  99999999999999996733616880411669127384953318580655547291796177947129\ 5845921727862608739868455465243.77 from reference etot 3812.23 greater than 0.01
H_CONS=  0  reference=  1872.981
difference  1872.981 from reference etot 1872.981 greater than 0.01
ERROR largest abs(1-numerical/analytical) 1.0000000000
 greater than 0.0070