Sunday, September 22 2024 09:47:22
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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 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 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 initializeInside initializeInside initialize MPI: node= 1 iseed= -6119485 MPI: node= 0 iseed= -3059742 indpdb= 0 pdbref= F Call Read_Bridge. ns= 0 Processor 1 0 0 ivec_start 1 ivec_end 21 indpdb= 0 pdbref= F Call Read_Bridge. ns= 0 Processor 0 0 0 ivec_start 1 ivec_end 21 MPI: node= 3 iseed= -12238971 MPI: node= 2 iseed= -9179228 indpdb= 0 pdbref= F Call Read_Bridge. ns= 0 Processor 3 0 0 ivec_start 1 ivec_end 21 indpdb= 0 pdbref= F Call Read_Bridge. ns= 0 Processor 2 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 End of minim, proc 1 time 122.75191783905029 End of minim, proc 2 time 122.75193095207214 End of cycle, master time for 36 iters 122.76334905624390 sec, Eval/s 10007.726324223417 End of minim, proc 3 time 122.77433419227600 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 1 time 328.27149081230164 End of minim, proc 3 time 328.27149200439453 End of minim, proc 2 time 328.34043478965759 End of cycle, master time for 55 iters 197.58701181411743 sec, Eval/s 9905.2310272357863 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 End of minim, proc 2 time 407.29324579238892 End of minim, proc 3 time 407.42859506607056 End of minim, proc 1 time 407.49667286872864 End of cycle, master time for 19 iters 71.490714073181152 sec, Eval/s 9888.9066806119517 UPDATING 3 4 End of RUN, master time 407.50504398345947 sec, Eval/s 9933.4426892745505 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= 31.52678 Emin= 31.52678 Emin= 31.52678 Emin= 31.52678 difference .00001 from reference emin 31.52677 difference .00001 from reference emin 31.52677 difference .00001 from reference emin 31.52677 difference .00001 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
