src/io/parse_interface.h

 /*
 * Copyright (c) 2005 The University of Notre Dame. All Rights Reserved.
 *
 * The University of Notre Dame grants you ("Licensee") a
 * non-exclusive, royalty free, license to use, modify and
 * redistribute this software in source and binary code form, provided
 * that the following conditions are met:
 *
 * 1. Acknowledgement of the program authors must be made in any
 *    publication of scientific results based in part on use of the
 *    program.  An acceptable form of acknowledgement is citation of
 *    the article in which the program was described (Matthew
 *    A. Meineke, Charles F. Vardeman II, Teng Lin, Christopher
 *    J. Fennell and J. Daniel Gezelter, "OOPSE: An Object-Oriented
 *    Parallel Simulation Engine for Molecular Dynamics,"
 *    J. Comput. Chem. 26, pp. 252-271 (2005))
 *
 * 2. Redistributions of source code must retain the above copyright
 *    notice, this list of conditions and the following disclaimer.
 *
 * 3. Redistributions in binary form must reproduce the above copyright
 *    notice, this list of conditions and the following disclaimer in the
 *    documentation and/or other materials provided with the
 *    distribution.
 *
 * This software is provided "AS IS," without a warranty of any
 * kind. All express or implied conditions, representations and
 * warranties, including any implied warranty of merchantability,
 * fitness for a particular purpose or non-infringement, are hereby
 * excluded.  The University of Notre Dame and its licensors shall not
 * be liable for any damages suffered by licensee as a result of
 * using, modifying or distributing the software or its
 * derivatives. In no event will the University of Notre Dame or its
 * licensors be liable for any lost revenue, profit or data, or for
 * direct, indirect, special, consequential, incidental or punitive
 * damages, however caused and regardless of the theory of liability,
 * arising out of the use of or inability to use software, even if the
 * University of Notre Dame has been advised of the possibility of
 * such damages.
 */
 
#ifndef IO_INTERFACE_H
#define IO_INTERFACE_H

#include "io/node_list.h"

/*
 * the following is used to clarify the namespace of a given statement
 * or block node.
 */

struct namespc{
  int index;
  node_type type;
};

/*
 * The following are the function calls to initialize the different
 * code blocks.
 */

extern void init_component( int component_index );
extern void init_molecule( int mol_index );
extern void init_atom( int atom_index );
extern void init_bond( int bond_index );
extern void init_bend( int bend_index );
extern void init_torsion( int torsion_index );
extern void init_zconstraint( int zconstraint_index );
extern void init_rigidbody( int rigidbody_index );
extern void init_cutoffgroup( int cutoffgroup_index );


/*
 * the next few deal with the statement initializations 
 */

extern void init_members( struct node_tag* the_node, 
                          struct namespc the_namespc );
extern void init_constraint( struct node_tag* the_node, 
                             struct namespc the_namespc );
extern void init_assignment( struct node_tag* the_node, 
                             struct namespc the_namespc );
extern void init_position( struct node_tag* the_node, 
                           struct namespc the_namespc );
extern void init_orientation( struct node_tag* the_node, 
                              struct namespc the_namespc );
extern void init_start_index( struct node_tag* the_node, 
                              struct namespc the_namespc );
/*
 * This let's us know when we encounter the end of a block.
 */

extern void end_of_block( void );


#endif
Revision:	1930
Committed:	Wed Jan 12 22:41:40 2005 UTC (19 years, 5 months ago) by gezelter
Content type:	text/plain
File size:	3559 byte(s)
Log Message:	merging new_design branch into OOPSE-2.0
#	Content
1	/*
2	* Copyright (c) 2005 The University of Notre Dame. All Rights Reserved.
3	*
4	* The University of Notre Dame grants you ("Licensee") a
5	* non-exclusive, royalty free, license to use, modify and
6	* redistribute this software in source and binary code form, provided
7	* that the following conditions are met:
8	*
9	* 1. Acknowledgement of the program authors must be made in any
10	* publication of scientific results based in part on use of the
11	* program. An acceptable form of acknowledgement is citation of
12	* the article in which the program was described (Matthew
13	* A. Meineke, Charles F. Vardeman II, Teng Lin, Christopher
14	* J. Fennell and J. Daniel Gezelter, "OOPSE: An Object-Oriented
15	* Parallel Simulation Engine for Molecular Dynamics,"
16	* J. Comput. Chem. 26, pp. 252-271 (2005))
17	*
18	* 2. Redistributions of source code must retain the above copyright
19	* notice, this list of conditions and the following disclaimer.
20	*
21	* 3. Redistributions in binary form must reproduce the above copyright
22	* notice, this list of conditions and the following disclaimer in the
23	* documentation and/or other materials provided with the
24	* distribution.
25	*
26	* This software is provided "AS IS," without a warranty of any
27	* kind. All express or implied conditions, representations and
28	* warranties, including any implied warranty of merchantability,
29	* fitness for a particular purpose or non-infringement, are hereby
30	* excluded. The University of Notre Dame and its licensors shall not
31	* be liable for any damages suffered by licensee as a result of
32	* using, modifying or distributing the software or its
33	* derivatives. In no event will the University of Notre Dame or its
34	* licensors be liable for any lost revenue, profit or data, or for
35	* direct, indirect, special, consequential, incidental or punitive
36	* damages, however caused and regardless of the theory of liability,
37	* arising out of the use of or inability to use software, even if the
38	* University of Notre Dame has been advised of the possibility of
39	* such damages.
40	*/
41
42	#ifndef IO_INTERFACE_H
43	#define IO_INTERFACE_H
44
45	#include "io/node_list.h"
46
47	/*
48	* the following is used to clarify the namespace of a given statement
49	* or block node.
50	*/
51
52	struct namespc{
53	int index;
54	node_type type;
55	};
56
57	/*
58	* The following are the function calls to initialize the different
59	* code blocks.
60	*/
61
62	extern void init_component( int component_index );
63	extern void init_molecule( int mol_index );
64	extern void init_atom( int atom_index );
65	extern void init_bond( int bond_index );
66	extern void init_bend( int bend_index );
67	extern void init_torsion( int torsion_index );
68	extern void init_zconstraint( int zconstraint_index );
69	extern void init_rigidbody( int rigidbody_index );
70	extern void init_cutoffgroup( int cutoffgroup_index );
71
72
73	/*
74	* the next few deal with the statement initializations
75	*/
76
77	extern void init_members( struct node_tag* the_node,
78	struct namespc the_namespc );
79	extern void init_constraint( struct node_tag* the_node,
80	struct namespc the_namespc );
81	extern void init_assignment( struct node_tag* the_node,
82	struct namespc the_namespc );
83	extern void init_position( struct node_tag* the_node,
84	struct namespc the_namespc );
85	extern void init_orientation( struct node_tag* the_node,
86	struct namespc the_namespc );
87	extern void init_start_index( struct node_tag* the_node,
88	struct namespc the_namespc );
89	/*
90	* This let's us know when we encounter the end of a block.
91	*/
92
93	extern void end_of_block( void );
94
95
96	#endif