Sunday, September 22 2024 15:26:21
UNRES
19.86s
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CTEST_FULL_OUTPUT STOP Bye Bye... STOP Bye Bye... MPI: node= 0 iseed= -3059742 indpdb= 19 pdbref= T ns= 0 Call Read_Bridge. ns= 0 Processor 1 CG group 0 absolute rank 1 leves ERGASTULUM. Total wall clock time 19.813139915466309 sec Processor 0 BROADCAST time 3.4446477890014648E-002 REDUCE time 0.40921068191528320 GATHER time 0.0000000000000000 SCATTER time 1.9777536392211914E-002 SENDRECV 0.0000000000000000 BARRIER ene 2.2087812423706055E-002 BARRIER grad 1.7112255096435547E-002 CG processor 0 is finishing work. Processor 1 wait times for respective orders order[ 0 ] 0.15192365646362305 order[ 1 ] 1.6837358474731445E-002 order[ 2 ] 0.0000000000000000 order[ 3 ] 6.9532499101570400E-310 order[ 4 ] 0.99245619773864746 order[ 5 ] 2.0595683258875225E-316 order[ 6 ] 6.9532499101562494E-310 order[ 7 ] 0.79799056053161621 order[ 8 ] 0.0000000000000000 order[ 9 ] 2.3410620521162221E-310 order[ 10 ] 2.3410620517600996E-310 average total energy -173.659 standard deviation 0.000321536
