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35 /*! \libinternal \file
37 * \brief This file makes declarations used for building
41 * \ingroup module_domdec
44 #ifndef GMX_DOMDEC_LOCALTOPOLOGY_H
45 #define GMX_DOMDEC_LOCALTOPOLOGY_H
47 #include "gromacs/math/vectypes.h"
50 struct gmx_domdec_zones_t;
51 struct gmx_localtop_t;
62 /*! \brief Generate the local topology and virtual site data
64 * \returns Total count of bonded interactions in the local topology on this domain */
65 int dd_make_local_top(const gmx_domdec_t& dd,
66 const gmx_domdec_zones_t& zones,
72 gmx::ArrayRef<const gmx::RVec> coordinates,
73 const gmx_mtop_t& top,
74 gmx::ArrayRef<const int64_t> atomInfo,
75 gmx_localtop_t* ltop);