StatePropagatorDataGpu object to manage GPU forces, positions and velocities buffers

[alexxy/gromacs.git] / src / gromacs / nbnxm / cuda / nbnxm_cuda_types.h

diff --git a/src/gromacs/nbnxm/cuda/nbnxm_cuda_types.h b/src/gromacs/nbnxm/cuda/nbnxm_cuda_types.h
index ec4b2b8d339592d85b5bd7e802dca928f001d1bb..f3fc0e88527c6626c0a4021e9b03898f47da8d61 100644 (file)
--- a/src/gromacs/nbnxm/cuda/nbnxm_cuda_types.h
+++ b/src/gromacs/nbnxm/cuda/nbnxm_cuda_types.h
@@ -219,18 +219,6 @@ struct gmx_nbnxn_cuda_t
     bool                                                            bUseTwoStreams;
     //! atom data
     cu_atomdata_t                                                  *atdat;
-    //! coordinates in rvec format
-    rvec                                                           *xrvec;
-    //! number of atoms
-    int                                                             natoms;
-    //! number of atoms allocated in device buffer
-    int                                                             natoms_alloc;
-    //! force in rvec format
-    rvec                                                           *frvec;
-    //! number of atoms in force buffer
-    int                                                             nfrvec;
-    //! number of atoms allocated in force buffer
-    int                                                             nfrvec_alloc;
     //! f buf ops cell index mapping
     int                                                            *cell;
     //! number of indices in cell buffer