Sort all includes in src/gromacs

[alexxy/gromacs.git] / src / gromacs / gmxpreprocess / vsite_parm.h

diff --git a/src/gromacs/gmxpreprocess/vsite_parm.h b/src/gromacs/gmxpreprocess/vsite_parm.h
index da246cd40bc7e52c95c44ddfd67b539c6244fb98..3001e74bc0f217665a9b0dc1048df76c894e09d8 100644 (file)
--- a/src/gromacs/gmxpreprocess/vsite_parm.h
+++ b/src/gromacs/gmxpreprocess/vsite_parm.h
@@ -1,54 +1,64 @@
 /*
- * 
- *                This source code is part of
- * 
- *                 G   R   O   M   A   C   S
- * 
- *          GROningen MAchine for Chemical Simulations
- * 
- *                        VERSION 3.2.0
- * Written by David van der Spoel, Erik Lindahl, Berk Hess, and others.
+ * This file is part of the GROMACS molecular simulation package.
+ *
  * Copyright (c) 1991-2000, University of Groningen, The Netherlands.
- * Copyright (c) 2001-2004, The GROMACS development team,
- * check out http://www.gromacs.org for more information.
-
- * This program is free software; you can redistribute it and/or
- * modify it under the terms of the GNU General Public License
- * as published by the Free Software Foundation; either version 2
+ * Copyright (c) 2001-2004, The GROMACS development team.
+ * Copyright (c) 2013,2014, 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.
+ *
+ * GROMACS is free software; you can redistribute it and/or
+ * modify it under the terms of the GNU Lesser General Public License
+ * as published by the Free Software Foundation; either version 2.1
  * of the License, or (at your option) any later version.
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- * files - if they are missing, get the official version at www.gromacs.org.
- * 
+ *
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+ * control is crucial - bugs must be traceable. We will be happy to
+ * consider code for inclusion in the official distribution, but
+ * derived work must not be called official GROMACS. Details are found
+ * in the README & COPYING files - if they are missing, get the
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+ *
  * To help us fund GROMACS development, we humbly ask that you cite
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+ * the research papers on the package. Check out http://www.gromacs.org.
  */
 
-#ifndef _vsite_parm_h
-#define _vsite_parm_h
+#ifndef GMX_GMXPREPROCESS_VSITE_PARM_H
+#define GMX_GMXPREPROCESS_VSITE_PARM_H
+
+#include "gromacs/gmxpreprocess/gpp_atomtype.h"
+#include "gromacs/gmxpreprocess/grompp-impl.h"
+#include "gromacs/legacyheaders/typedefs.h"
 
-#include "typedefs.h"
-#include "grompp.h"
-#include "gpp_atomtype.h"
+#ifdef __cplusplus
+extern "C" {
+#endif
 
-extern int set_vsites(gmx_bool bVerbose, t_atoms *atoms,  gpp_atomtype_t atype,
-                     t_params plist[]);
-/* set parameters for vritual sites, return number of virtual sites */
+int set_vsites(gmx_bool bVerbose, t_atoms *atoms,  gpp_atomtype_t atype,
+               t_params plist[]);
+/* set parameters for virtual sites, return number of virtual sites */
 
-extern void set_vsites_ptype(gmx_bool bVerbose,  gmx_moltype_t *molt);
+void set_vsites_ptype(gmx_bool bVerbose,  gmx_moltype_t *molt);
 /* set ptype to VSite for virtual sites */
 
-extern void clean_vsite_bondeds(t_params *ps, int natoms, gmx_bool bRmVSiteBds);
+void clean_vsite_bondeds(t_params *ps, int natoms, gmx_bool bRmVSiteBds);
 /* remove all bonded interaction (bonds, angles and diherals) that
    have become obsolete due to virtual site constructions */
 
-#endif /* _vsite_parm_h */
+#ifdef __cplusplus
+}
+#endif
+
+#endif