src/programs/view/nmol.h

   1 /*
   2  * This file is part of the GROMACS molecular simulation package.
   3  *
   4  * Copyright (c) 1991-2000, University of Groningen, The Netherlands.
   5  * Copyright (c) 2001-2004, The GROMACS development team.
   6  * Copyright (c) 2013,2014, 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.
  10  *
  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.
  15  *
  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.
  20  *
  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.
  25  *
  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.
  33  *
  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.
  36  */
  37
  38 #ifndef _nmol_h
  39 #define _nmol_h
  40
  41 #include "manager.h"
  42 #include "x11.h"
  43 #include "xutil.h"
  44
  45 extern t_molwin *init_mw(t_x11 *x11, Window Parent,
  46                          int x, int y, int width, int height,
  47                          unsigned long fg, unsigned long bg,
  48                          int ePBC, matrix box);
  49 /* Create the molecule window using the x,y etc. */
  50
  51 extern void map_mw(t_x11 *x11, t_molwin *mw);
  52
  53 extern void z_fill(t_manager *man, real *zz);
  54 extern int  compare_obj(const void *a, const void *b);
  55 extern int  filter_vis(t_manager *man);
  56 extern void set_sizes(t_manager *man);
  57
  58 extern bool toggle_hydrogen(t_x11 *x11, t_molwin *mw);
  59 /* Toggle the state of the hydrogen drawing,
  60  * return the current state
  61  */
  62
  63 extern void set_bond_type(t_x11 *x11, t_molwin *mw, int bt);
  64 /* Set the state of the atoms drawing. */
  65
  66 extern void set_box_type (t_x11 *x11, t_molwin *mw, int bt);
  67 /* Set the type of box or none (bt = 0)
  68  */
  69
  70 extern void done_mw(t_x11 *x11, t_molwin *mw);
  71
  72 #endif  /* _nmol_h */