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#ifdef __C |
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/** This header provides dual access for mpiComponenPlan |
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#ifndef __MPICOMPONENTPLAN_H__ |
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#define __MPICOMPONENTPLAN_H__ |
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/** This header provides dual access for mpiComponentPlan |
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structure in fortran and in c, C++. |
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*/ |
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typedef struct{ |
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int nMolGlobal; |
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int nAtomsGlobal; |
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int nGroupsGlobal; |
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int nBondsGlobal; |
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int nBendsGlobal; |
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int nTorsionsGlobal; |
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int nSRIGlobal; |
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int myMolStart; |
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int myMolEnd; |
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int myAtomStart; |
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int myAtomEnd; |
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int myMol; |
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int myNlocal; |
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int nMolLocal; |
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int nAtomsLocal; |
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int nGroupsLocal; |
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int myNode; |
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int numberProcessors; |
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int nProcessors; |
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int rowComm; |
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int columnComm; |
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int numberRows; |
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int numberColumns; |
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int nComponentsRow; |
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int nComponentsColumn; |
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int nRows; |
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int nColumns; |
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int nAtomsInRow; |
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int nAtomsInColumn; |
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int nGroupsInRow; |
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int nGroupsInColumn; |
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int rowIndex; |
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int columnIndex; |
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} mpiSimData; |
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#endif // __MPICOMPONENTPLAN_H__ |
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#endif |
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#endif // __C |
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#ifdef __FORTRAN90 |
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sequence |
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integer :: nMolGlobal = 0 |
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integer :: nAtomsGlobal = 0 |
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integer :: nGroupsGlobal = 0 |
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integer :: nBondsGlobal = 0 |
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integer :: nBendsGlobal = 0 |
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integer :: nTorsionsGlobal = 0 |
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integer :: nSRIGlobal = 0 |
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integer :: myMolStart = 0 |
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integer :: myMolEnd = 0 |
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integer :: myAtomStart = 0 |
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integer :: myAtomEnd = 0 |
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integer :: myMol = 0 |
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integer :: myNlocal = 0 |
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integer :: nMolLocal = 0 |
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integer :: nAtomsLocal = 0 |
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integer :: nGroupsLocal = 0 |
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integer :: myNode = 0 |
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integer :: numberProcessors = 0 |
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integer :: nProcessors = 0 |
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integer :: rowComm = 0 |
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integer :: columnComm = 0 |
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integer :: numberRows = 0 |
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integer :: numberColumns = 0 |
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integer :: nComponentsRow = 0 |
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integer :: nComponentsColumn = 0 |
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integer :: nRows = 0 |
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integer :: nColumns = 0 |
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integer :: nAtomsInRow = 0 |
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integer :: nAtomsInColumn = 0 |
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integer :: nGroupsInRow = 0 |
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integer :: nGroupsInColumn = 0 |
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integer :: rowIndex = 0 |
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integer :: columnIndex = 0 |
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end type mpiComponentPlan |
