src/gromacs/ewald/pme-spread.h

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  37 #ifndef GMX_EWALD_PME_SPREAD_H
  38 #define GMX_EWALD_PME_SPREAD_H
  39
  40 #include "gromacs/utility/real.h"
  41
  42 #include "pme-internal.h"
  43
  44 void
  45 spread_on_grid(const gmx_pme_t *pme,
  46                const pme_atomcomm_t *atc, const pmegrids_t *grids,
  47                gmx_bool bCalcSplines, gmx_bool bSpread,
  48                real *fftgrid, gmx_bool bDoSplines, int grid_index);
  49
  50 #endif