#include "gromacs/mdtypes/mdatom.h"
#include "gromacs/pbcutil/pbc.h"
#include "gromacs/pbcutil/pbc_aiuc.h"
-#include "gromacs/topology/idef.h"
#include "gromacs/topology/topology.h"
+class InteractionDefinitions;
+
namespace gmx
{
* \param[in] idef System topology
* \param[in] md Atoms data. Can be used to update masses if needed (not used now).
*/
- void set(const t_idef& idef, const t_mdatoms& md);
+ void set(const InteractionDefinitions& idef, const t_mdatoms& md);
private:
//! GPU stream