Merge release-5-0 into master

[alexxy/gromacs.git] / src / gromacs / fileio / tngio.h

diff --git a/src/gromacs/fileio/tngio.h b/src/gromacs/fileio/tngio.h
index 1f439c537aba1467d33471c63d22032fd114265f..578b8f57edb3bd1c328cade6a75dac4e403987c4 100644 (file)
--- a/src/gromacs/fileio/tngio.h
+++ b/src/gromacs/fileio/tngio.h
@@ -36,9 +36,12 @@
 #ifndef GMX_FILEIO_TNGIO_H
 #define GMX_FILEIO_TNGIO_H
 
-#include "gromacs/legacyheaders/typedefs.h"
 #include "tng/tng_io_fwd.h"
 
+#include "gromacs/legacyheaders/types/inputrec.h"
+#include "gromacs/math/vectypes.h"
+#include "gromacs/utility/real.h"
+
 #ifdef __cplusplus
 extern "C" {
 #endif
@@ -46,6 +49,8 @@ extern "C" {
 }
 #endif
 
+struct gmx_mtop_t;
+
 /*! \brief Open a TNG trajectory file
  *
  * \param filename   Name of file to open
@@ -67,8 +72,8 @@ void gmx_tng_close(tng_trajectory_t *tng);
  * \param tng   Valid handle to a TNG trajectory
  * \param mtop  Pointer to a topology (can be NULL)
  */
-void gmx_tng_add_mtop(tng_trajectory_t  tng,
-                      const gmx_mtop_t *mtop);
+void gmx_tng_add_mtop(tng_trajectory_t         tng,
+                      const struct gmx_mtop_t *mtop);
 
 /*! \brief Do all TNG preparation for full-precision whole-system
  * trajectory writing during MD simulations.
@@ -77,9 +82,9 @@ void gmx_tng_add_mtop(tng_trajectory_t  tng,
  * \param mtop  Global topology
  * \param ir    Input settings (for writing frequencies)
  */
-void gmx_tng_prepare_md_writing(tng_trajectory_t  tng,
-                                const gmx_mtop_t *mtop,
-                                const t_inputrec *ir);
+void gmx_tng_prepare_md_writing(tng_trajectory_t         tng,
+                                const struct gmx_mtop_t *mtop,
+                                const t_inputrec        *ir);
 
 /*! \brief Set the default compression precision for TNG writing
  *
@@ -95,9 +100,9 @@ void gmx_tng_set_compression_precision(tng_trajectory_t tng,
  * \param mtop  Global topology
  * \param ir    Input settings (for writing frequencies)
  */
-void gmx_tng_prepare_low_prec_writing(tng_trajectory_t  tng,
-                                      const gmx_mtop_t *mtop,
-                                      const t_inputrec *ir);
+void gmx_tng_prepare_low_prec_writing(tng_trajectory_t         tng,
+                                      const struct gmx_mtop_t *mtop,
+                                      const t_inputrec        *ir);
 
 /*! \brief Write a frame to a TNG file
  *