{
class Constraints;
class MDAtoms;
-}
+} // namespace gmx
/*! \brief Gets the local shell with domain decomposition
*
* \param[in] md The MD atom data
* \param[in,out] shfc The shell/flexible-constraint data
*/
-void make_local_shells(const t_commrec *cr,
- const t_mdatoms *md,
- gmx_shellfc_t *shfc);
+void make_local_shells(const t_commrec* cr, const t_mdatoms* md, gmx_shellfc_t* shfc);
/*! \brief Sets atom data for several MD algorithms
*
* \param[in,out] vsite The virtual site data, can be NULL
* \param[in,out] shellfc The shell/flexible-constraint data, can be NULL
*/
-void mdAlgorithmsSetupAtomData(const t_commrec *cr,
- const t_inputrec *ir,
- const gmx_mtop_t &top_global,
- gmx_localtop_t *top,
- t_forcerec *fr,
- t_graph **graph,
- gmx::MDAtoms *mdAtoms,
- gmx::Constraints *constr,
- gmx_vsite_t *vsite,
- gmx_shellfc_t *shellfc);
+void mdAlgorithmsSetupAtomData(const t_commrec* cr,
+ const t_inputrec* ir,
+ const gmx_mtop_t& top_global,
+ gmx_localtop_t* top,
+ t_forcerec* fr,
+ t_graph** graph,
+ gmx::MDAtoms* mdAtoms,
+ gmx::Constraints* constr,
+ gmx_vsite_t* vsite,
+ gmx_shellfc_t* shellfc);
#endif