Monday, September 23 2024 19:26:03
UNRES
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CTEST_FULL_OUTPUT CTEST_FULL_OUTPUT CTEST_FULL_OUTPUT CTEST_FULL_OUTPUT Processor 0 out of 4 rank in CG_COMM 0 size of CG_COMM 4 size of FG_COMM 1 rank in FG_COMM1 0 size of FG_COMM1 1 Processor 1 out of 4 rank in CG_COMM 1 size of CG_COMM 4 size of FG_COMM 1 rank in FG_COMM1 0 size of FG_COMM1 1 Processor 2 out of 4 rank in CG_COMM 2 size of CG_COMM 4 size of FG_COMM 1 rank in FG_COMM1 0 size of FG_COMM1 1 Processor 3 out of 4 rank in CG_COMM 3 size of CG_COMM 4 size of FG_COMM 1 rank in FG_COMM1 0 size of FG_COMM1 1 Inside initializeInside initializeInside initializeInside initialize MPI: node= 1 iseed= -6119485 MPI: node= 2 iseed= -9179228 MPI: node= 0 iseed= -3059742 indpdb= 0 pdbref= F indpdb= 0 pdbref= F indpdb= 0 pdbref= F Call Read_Bridge. ns= 0 Call Read_Bridge. ns= 0 Call Read_Bridge. ns= 0 Processor 1 0 0 ivec_start 1 ivec_end 21 Processor 2 0 0 ivec_start 1 ivec_end 21 Processor 0 0 0 ivec_start 1 ivec_end 21 MPI: node= 3 iseed= -12238971 indpdb= 0 pdbref= F Call Read_Bridge. ns= 0 Processor 3 0 0 ivec_start 1 ivec_end 21 Exitted from make_ranvar nconfr= 100 FEEDIN: NCONF= 100 UPDATING 97 97 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 End of minim, proc 3 time 136.66828584671021 End of minim, proc 1 time 136.66830992698669 End of cycle, master time for 41 iters 136.66339397430420 sec, Eval/s 10201.627220396260 End of minim, proc 2 time 136.67388796806335 UPDATING 3 4 Exitted from make_ranvar nconfr= 100 FEEDIN: NCONF= 100 UPDATING 97 97 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 End of minim, proc 3 time 345.85104894638062 End of minim, proc 1 time 345.85106205940247 End of cycle, master time for 58 iters 201.31121706962585 sec, Eval/s 10060.865109665021 End of minim, proc 2 time 345.87791109085083 UPDATING 3 4 Exitted from make_ranvar nconfr= 100 FEEDIN: NCONF= 100 UPDATING 97 97 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 UPDATING 100 100 End of minim, proc 2 time 408.04738116264343 End of minim, proc 3 time 408.15259695053101 End of minim, proc 1 time 408.24683213233948 End of cycle, master time for 11 iters 54.759367942810059 sec, Eval/s 9981.7076152313020 UPDATING 3 4 End of RUN, master time 408.25569915771484 sec, Eval/s 10095.099734070958 CG processor 0 is finishing work. CG processor 1 is finishing work. CG processor 2 is finishing work. CG processor 3 is finishing work. STOP Bye Bye... STOP Bye Bye... STOP Bye Bye... STOP Bye Bye... Emin= 31.50630 Emin= 31.50630 Emin= 31.50630 Emin= 31.50630 difference .02047 from reference emin 31.52677 difference .02047 from reference emin 31.52677 difference .02047 from reference emin 31.52677 difference .02047 from reference emin 31.52677 grep: 1l2y_csa_local_4P*.pdb: No such file or directory grep: 1l2y_csa_local_4P*.pdb: No such file or directory grep: 1l2y_csa_local_4P*.pdb: No such file or directory grep: 1l2y_csa_local_4P*.pdb: No such file or directory
