StatePropagatorDataGpu object to manage GPU forces, positions and velocities buffers

[alexxy/gromacs.git] / src / gromacs / domdec / domdec.h

diff --git a/src/gromacs/domdec/domdec.h b/src/gromacs/domdec/domdec.h
index 9405a030ecff6a096d93475e5df5a7a6f9969d54..97b38a4300a396522115ffc07b233342cd47aec5 100644 (file)
--- a/src/gromacs/domdec/domdec.h
+++ b/src/gromacs/domdec/domdec.h
@@ -110,6 +110,9 @@ void dd_store_state(struct gmx_domdec_t *dd, t_state *state);
 /*! \brief Returns a pointer to the gmx_domdec_zones_t struct */
 struct gmx_domdec_zones_t *domdec_zones(struct gmx_domdec_t *dd);
 
+/*! \brief Returns the range for atoms in zones*/
+int dd_numAtomsZones(const gmx_domdec_t &dd);
+
 /*! \brief Returns the number of home atoms */
 int dd_numHomeAtoms(const gmx_domdec_t &dd);