Sort all includes in src/gromacs

[alexxy/gromacs.git] / src / gromacs / gmxlib / nonbonded / nb_kernel_c / nb_kernel_allvsall.h

diff --git a/src/gromacs/gmxlib/nonbonded/nb_kernel_c/nb_kernel_allvsall.h b/src/gromacs/gmxlib/nonbonded/nb_kernel_c/nb_kernel_allvsall.h
index d8ca9d2a046b27e773adaaf7b8aac51b925cf64e..62b60ca939f3770c5341beec8da4f6d9ce4fc6ce 100644 (file)
--- a/src/gromacs/gmxlib/nonbonded/nb_kernel_c/nb_kernel_allvsall.h
+++ b/src/gromacs/gmxlib/nonbonded/nb_kernel_c/nb_kernel_allvsall.h
@@ -1,24 +1,54 @@
-
+/*
+ * This file is part of the GROMACS molecular simulation package.
+ *
+ * Copyright (c) 2012,2014, 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.
+ *
+ * GROMACS is distributed in the hope that it will be useful,
+ * but WITHOUT ANY WARRANTY; without even the implied warranty of
+ * MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE.  See the GNU
+ * Lesser General Public License for more details.
+ *
+ * You should have received a copy of the GNU Lesser General Public
+ * License along with GROMACS; if not, see
+ * http://www.gnu.org/licenses, or write to the Free Software Foundation,
+ * Inc., 51 Franklin Street, Fifth Floor, Boston, MA  02110-1301  USA.
+ *
+ * If you want to redistribute modifications to GROMACS, please
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+ * derived work must not be called official GROMACS. Details are found
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+ *
+ * To help us fund GROMACS development, we humbly ask that you cite
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+ */
 #ifndef _NB_KERNEL_ALLVSALL_H
 #define _NB_KERNEL_ALLVSALL_H
 
-#ifdef HAVE_CONFIG_H
-#include <config.h>
-#endif
+#include "config.h"
 
-#include "types/simple.h"
-#include "typedefs.h"
+#include "gromacs/gmxlib/nonbonded/nb_kernel.h"
+#include "gromacs/legacyheaders/typedefs.h"
+#include "gromacs/legacyheaders/types/simple.h"
 
 void
-nb_kernel_allvsall(t_forcerec *           fr,
-                  t_mdatoms *            mdatoms,
-                  t_blocka *             excl,    
-                  real *                 x,
-                  real *                 f,
-                  real *                 Vc,
-                  real *                 Vvdw,
-                  int *                  outeriter,
-                  int *                  inneriter,
-                  void *                 work);
+nb_kernel_allvsall(t_nblist *                nlist,
+                   rvec *                    x,
+                   rvec *                    f,
+                   t_forcerec *              fr,
+                   t_mdatoms *               mdatoms,
+                   nb_kernel_data_t *        kernel_data,
+                   t_nrnb *                  nrnb);
+
 
 #endif