2 * This file is part of the GROMACS molecular simulation package.
4 * Copyright (c) 1991-2000, University of Groningen, The Netherlands.
5 * Copyright (c) 2001-2004, The GROMACS development team.
6 * Copyright (c) 2011,2014, by the GROMACS development team, led by
7 * Mark Abraham, David van der Spoel, Berk Hess, and Erik Lindahl,
8 * and including many others, as listed in the AUTHORS file in the
9 * top-level source directory and at http://www.gromacs.org.
11 * GROMACS is free software; you can redistribute it and/or
12 * modify it under the terms of the GNU Lesser General Public License
13 * as published by the Free Software Foundation; either version 2.1
14 * of the License, or (at your option) any later version.
16 * GROMACS is distributed in the hope that it will be useful,
17 * but WITHOUT ANY WARRANTY; without even the implied warranty of
18 * MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the GNU
19 * Lesser General Public License for more details.
21 * You should have received a copy of the GNU Lesser General Public
22 * License along with GROMACS; if not, see
23 * http://www.gnu.org/licenses, or write to the Free Software Foundation,
24 * Inc., 51 Franklin Street, Fifth Floor, Boston, MA 02110-1301 USA.
26 * If you want to redistribute modifications to GROMACS, please
27 * consider that scientific software is very special. Version
28 * control is crucial - bugs must be traceable. We will be happy to
29 * consider code for inclusion in the official distribution, but
30 * derived work must not be called official GROMACS. Details are found
31 * in the README & COPYING files - if they are missing, get the
32 * official version at http://www.gromacs.org.
34 * To help us fund GROMACS development, we humbly ask that you cite
35 * the research papers on the package. Check out http://www.gromacs.org.
38 #ifndef GMX_GMXPREPROCESS_H_DB_H
39 #define GMX_GMXPREPROCESS_H_DB_H
43 #include "gromacs/gmxpreprocess/hackblock.h"
49 /* functions for the h-database */
51 void read_ab(char *line, const char *fn, t_hack *ab);
52 /* Read one add block */
54 int read_h_db(const char *ffdir, t_hackblock **ah);
55 /* Read the database from hdb file(s) in ffdir or current dir */
57 void print_ab(FILE *out, t_hack *ab, char *nname);
58 /* print one add block */
60 void print_h_db(FILE *out, int nh, t_hackblock ah[]);
61 /* Print the database to file */
63 int compaddh(const void *a, const void *b);
65 t_hackblock *search_h_db(int nh, t_hackblock ah[], char *key);
66 /* Search for an entry in the database */