};
//! Sets the atomdata after pair search
-void nbnxn_atomdata_set(nbnxn_atomdata_t* nbat,
- const Nbnxm::GridSet& gridSet,
- gmx::ArrayRef<const int> atomTypes,
- gmx::ArrayRef<const real> atomCharges,
- gmx::ArrayRef<const int> atomInfo);
+void nbnxn_atomdata_set(nbnxn_atomdata_t* nbat,
+ const Nbnxm::GridSet& gridSet,
+ gmx::ArrayRef<const int> atomTypes,
+ gmx::ArrayRef<const real> atomCharges,
+ gmx::ArrayRef<const int64_t> atomInfo);
//! Copy the shift vectors to nbat
void nbnxn_atomdata_copy_shiftvec(bool dynamic_box, gmx::ArrayRef<gmx::RVec> shift_vec, nbnxn_atomdata_t* nbat);