X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;ds=inline;f=source%2Funres%2Fsrc_MD%2FMREMD.F;h=be6af9c877e7446b716a6a47271d12516d2da8aa;hb=73ca05fce4b785367bd9600c24a7f026feff14bf;hp=34a5343b6e73725c582528e1143184d6d6430cd3;hpb=79854d858b2df03320c654ee73f0ee891efca800;p=unres.git diff --git a/source/unres/src_MD/MREMD.F b/source/unres/src_MD/MREMD.F index 34a5343..be6af9c 100644 --- a/source/unres/src_MD/MREMD.F +++ b/source/unres/src_MD/MREMD.F @@ -1705,8 +1705,8 @@ ctime call flush(iout) call xdrfint_(ixdrf, nss, iret) do j=1,nss if (dyn_ss) then - call xdrfint(ixdrf, idssb(j)+nres, iret) - call xdrfint(ixdrf, jdssb(j)+nres, iret) + call xdrfint_(ixdrf, idssb(j)+nres, iret) + call xdrfint_(ixdrf, jdssb(j)+nres, iret) else call xdrfint_(ixdrf, ihpb(j), iret) call xdrfint_(ixdrf, jhpb(j), iret) @@ -1996,9 +1996,14 @@ c & (d_restart1(j,i+2*nres*il),j=1,3) enddo endif #endif - call mpi_scatter(i2set,1,mpi_integer, - & iset,1,mpi_integer,king, - & CG_COMM,ierr) +c Corrected AL 8/19/2014: each processor needs whole iset array not only its +c own element +c call mpi_scatter(i2set,1,mpi_integer, +c & iset,1,mpi_integer,king, +c & CG_COMM,ierr) + call mpi_bcast(i2set(0),nodes,mpi_integer,king, + & CG_COMM,ierr) + iset=i2set(me) endif