--- trunk/OOPSE/libmdtools/DUFF.cpp 2003/08/20 19:11:51 704 +++ trunk/OOPSE/libmdtools/DUFF.cpp 2003/08/26 18:32:03 721 @@ -476,7 +476,7 @@ DUFF::DUFF(){ // Init the atomStruct mpi type atomStruct atomProto; // mpiPrototype - int atomBC[3] = {15,6,4}; // block counts + int atomBC[3] = {15,11,4}; // block counts MPI_Aint atomDspls[3]; // displacements MPI_Datatype atomMbrTypes[3]; // member mpi types @@ -1310,8 +1310,7 @@ void DUFF::initializeBends( int nBends, Bend** bendArr } gBend = new GhostBend( *the_atoms[a], - *the_atoms[b], - *the_atoms[c] ); + *the_atoms[b]); gBend->setConstants( currentBendType->k1, currentBendType->k2,