random generation for nucleic acids

[unres4.git] / source / unres / MREMD.F90

diff --git a/source/unres/MREMD.F90 b/source/unres/MREMD.F90
index 87953ac..e662e63 100644 (file)
--- a/source/unres/MREMD.F90
+++ b/source/unres/MREMD.F90
@@ -744,26 +744,26 @@
            synflag=.true.
            if (me.eq.king .or. .not. out1file) &
             write(iout,*) 'REMD synchro at1',itime,ntwx_cache,Nprocs,nodes
-!!!!!! TRIAL OF MINIM SYNC
-            if (me.eq.king) then
-           do i=1,nodes-1
-              call mpi_isend(itime,1,MPI_INTEGER,i,101, &
-                                      CG_COMM, ireqi(i), ierr)
-!d            write(iout,*) 'REMD synchro with',i
-!d            call flush(iout)
-           enddo
-           call mpi_waitall(nodes-1,ireqi,statusi,ierr)
-           call mpi_barrier(CG_COMM, ierr)
-           time01=MPI_WTIME()
-            endif
+!!!!!!! TRIAL OF MINIM SYNC
+!            if (me.eq.king) then
+!           do i=1,nodes-1
+!              call mpi_isend(itime,1,MPI_INTEGER,i,101, &
+!                                      CG_COMM, ireqi(i), ierr)
+!!d            write(iout,*) 'REMD synchro with',i
+!!d            call flush(iout)
+!           enddo
+!           call mpi_waitall(nodes-1,ireqi,statusi,ierr)
+!           call mpi_barrier(CG_COMM, ierr)
+!           time01=MPI_WTIME()
+!            endif
 !!!!!!!!!!!!!!!!
-           if (me.ne.king) then
-               call mpi_recv(itime_master, 1, MPI_INTEGER,&
-                                   0,101,CG_COMM, status, ierr)
-               call mpi_barrier(CG_COMM, ierr)
+!           if (me.ne.king) then
+!               call mpi_recv(itime_master, 1, MPI_INTEGER,&
+!                                   0,101,CG_COMM, status, ierr)
+!               call mpi_barrier(CG_COMM, ierr)
 !deb               if (out1file.or.traj1file) then
 !
-            endif
+!            endif
             write(iout,*) icache_all
             if(traj1file) then
               write(iout,*) "before mpi_gather ntwx_cache"