Thursday, September 19 2024 19:24:20
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 Inside initialize 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 initialize 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 Inside initializeInside initialize MPI: node= 1 iseed= -6119485 MPI: node= 2 iseed= -9179228 MPI: node= 3 iseed= -12238971 indpdb= 0 pdbref= F Call Read_Bridge. ns= 0 indpdb= 0 pdbref= F indpdb= 0 pdbref= F Processor 1 0 0 ivec_start 1 ivec_end 21 Call Read_Bridge. ns= 0 Call Read_Bridge. ns= 0 Processor 2 0 0 ivec_start 1 ivec_end 21 Processor 3 0 0 ivec_start 1 ivec_end 21 MPI: node= 0 iseed= -3059742 indpdb= 0 pdbref= F Call Read_Bridge. ns= 0 Processor 0 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 1 time 1683856002.2707341 End of minim, proc 2 time 1683856002.2707469 End of cycle, master time for 41 iters 112.11636710166931 sec, Eval/s 11716.308991788959 End of minim, proc 3 time 1683856002.4246299 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 End of minim, proc 3 time 1683856150.6164241 End of cycle, master time for 55 iters 141.52579689025879 sec, Eval/s 12531.934382077847 End of minim, proc 1 time 1683856150.6164670 End of minim, proc 2 time 1683856150.6164861 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 End of minim, proc 1 time 1683856198.7261951 End of minim, proc 2 time 1683856198.7262220 End of cycle, master time for 14 iters 42.321244955062866 sec, Eval/s 14433.176544040365 End of minim, proc 3 time 1683856198.8491781 UPDATING 3 4 End of RUN, master time 308.56381511688232 sec, Eval/s 12480.948223112933 CG processor 0 is finishing work. CG processor 1 is finishing work. CG processor 3 is finishing work. CG processor 2 is finishing work. Note: The following floating-point exceptions are signalling: IEEE_INVALID_FLAG IEEE_OVERFLOW_FLAG IEEE_UNDERFLOW_FLAG IEEE_DENORMAL STOP Bye Bye... Note: The following floating-point exceptions are signalling: IEEE_UNDERFLOW_FLAG IEEE_DENORMAL STOP Bye Bye... Note: The following floating-point exceptions are signalling: IEEE_UNDERFLOW_FLAG IEEE_DENORMAL STOP Bye Bye... STOP Bye Bye... Emin= 31.50622 Emin= 31.50622 Emin= 31.50622 Emin= 31.50622 difference .02055 from reference emin 31.52677 difference .02055 from reference emin 31.52677 difference .02055 from reference emin 31.52677 difference .02055 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
