src/gromacs/mdlib/genborn_sse2_single.h

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  37 #ifndef _genborn_sse_h
  38 #define _genborn_sse_h
  39
  40 #include "gromacs/legacyheaders/typedefs.h"
  41
  42 float
  43 calc_gb_chainrule_sse2_single(int natoms, t_nblist *nl, float *dadx, float *dvda,
  44                               float *xd, float *f, float *fshift, float *shift_vec,
  45                               int gb_algorithm, gmx_genborn_t *born, t_mdatoms *md);
  46
  47 int
  48 calc_gb_rad_still_sse2_single(t_commrec *cr, t_forcerec *fr, int natoms, gmx_localtop_t *top,
  49                               float *x, t_nblist *nl, gmx_genborn_t *born);
  50
  51 int
  52 calc_gb_rad_hct_obc_sse2_single(t_commrec *cr, t_forcerec * fr, int natoms, gmx_localtop_t *top,
  53                                 float *x, t_nblist *nl, gmx_genborn_t *born, t_mdatoms *md, int gb_algorithm);
  54
  55 #endif /* _genborn_sse_h */