Sort all includes in src/gromacs

[alexxy/gromacs.git] / src / gromacs / legacyheaders / chargegroup.h

diff --git a/src/gromacs/legacyheaders/chargegroup.h b/src/gromacs/legacyheaders/chargegroup.h
index 2fab5bc79cc1b21aa934691515a6e9ffc4f9fd59..26c81b081bdf452592934bf6ffa3f181d5ca47eb 100644 (file)
--- a/src/gromacs/legacyheaders/chargegroup.h
+++ b/src/gromacs/legacyheaders/chargegroup.h
@@ -3,7 +3,7 @@
  *
  * Copyright (c) 1991-2000, University of Groningen, The Netherlands.
  * Copyright (c) 2001-2004, The GROMACS development team.
- * Copyright (c) 2010, by the GROMACS development team, led by
+ * Copyright (c) 2010,2014, by the GROMACS development team, led by
  * Mark Abraham, David van der Spoel, Berk Hess, and Erik Lindahl,
  * and including many others, as listed in the AUTHORS file in the
  * top-level source directory and at http://www.gromacs.org.
@@ -38,28 +38,33 @@
 #ifndef _chargegroup_h
 #define _chargegroup_h
 
-#include "sysstuff.h"
-#include "typedefs.h"
+#include <stdio.h>
+
+#include "gromacs/math/vectypes.h"
+#include "gromacs/utility/real.h"
 
 #ifdef __cplusplus
 extern "C" {
 #endif
 
-void calc_chargegroup_radii(const gmx_mtop_t *mtop, rvec *x,
+struct gmx_mtop_t;
+struct t_block;
+
+void calc_chargegroup_radii(const struct gmx_mtop_t *mtop, rvec *x,
                             real *rvdw1, real *rvdw2,
                             real *rcoul1, real *rcoul2);
 /* This routine calculates the two largest charge group radii in x,
  * separately for VdW and Coulomb interactions.
  */
 
-void calc_cgcm(FILE *log, int cg0, int cg1, t_block *cgs,
+void calc_cgcm(FILE *log, int cg0, int cg1, struct t_block *cgs,
                rvec pos[], rvec cg_cm[]);
 /* Routine to compute centers of geometry of charge groups. No periodicity
  * is used.
  */
 
 void put_charge_groups_in_box (FILE *log, int cg0, int cg1,
-                               int ePBC, matrix box, t_block *cgs,
+                               int ePBC, matrix box, struct t_block *cgs,
                                rvec pos[],
                                rvec cg_cm[]);
 /* This routine puts charge groups in the periodic box, keeping them