--- trunk/mdtools/headers/mpiComponentPlan.h 2002/12/12 21:21:59 206 +++ trunk/mdtools/headers/mpiComponentPlan.h 2003/01/30 15:20:21 253 @@ -3,9 +3,13 @@ structure in fortran and in c, C++. */ -typdef struct{ +typedef struct{ int nMolGlobal; int nAtomsGlobal; + int nBondsGlobal; + int nBendsGlobal; + int nTorsionsGlobal; + int nSRIGlobal; int myMolStart; int myMolEnd; int myAtomStart; @@ -22,7 +26,7 @@ typdef struct{ int nComponentsColumn; int rowIndex; int columnIndex; -} mpiComponentPlan; +} mpiSimData; #endif @@ -33,6 +37,10 @@ type, public :: mpiComponentPlan sequence integer :: nMolGlobal = 0 integer :: nAtomsGlobal = 0 + integer :: nBondsGlobal = 0 + integer :: nBendsGlobal = 0 + integer :: nTorsionsGlobal = 0 + integer :: nSRIGlobal = 0 integer :: myMolStart = 0 integer :: myMolEnd = 0 integer :: myAtomStart = 0