source: src/Parser/FormatParser_common.hpp

Candidate_v1.6.1
Last change on this file was 0e894a, checked in by Frederik Heber <frederik.heber@…>, 7 years ago

Extracted getMinMaxTrajectories() into FormatParser_common.

  • Property mode set to 100644
File size: 2.1 KB
Line 
1/*
2 * FormatParser_common_common.hpp
3 *
4 * Created on: Mar 1, 2010
5 * Author: metzler
6 */
7
8#ifndef FORMATPARSER_COMMON_HPP_
9#define FORMATPARSER_COMMON_HPP_
10
11// include config.h
12#ifdef HAVE_CONFIG_H
13#include <config.h>
14#endif
15
16#include <iosfwd>
17#include <map>
18
19#include "CodePatterns/Observer/Observer.hpp"
20#include "FormatParserInterface.hpp"
21#include "FormatParser_Parameters.hpp"
22#include "types.hpp"
23
24namespace MoleCuilder {
25 class MoleculeLoadAction;
26}
27
28/**
29 * This class encapsulates everything that all specialized FormatParser variants
30 * have in common.
31 *
32 * This is because template classes cannot be partially specialization in a few
33 * functions. Hence, we place all stuff that is common into a separate class.
34 */
35class FormatParser_common : public Observer, virtual public FormatParserInterface
36{
37 friend class MoleCuilder::MoleculeLoadAction;
38public:
39 FormatParser_common(FormatParser_Parameters *_parameters);
40 virtual ~FormatParser_common();
41 void setOstream(std::ostream* file);
42
43protected:
44 void update(Observable *publisher);
45 void recieveNotification(Observable *publisher, Notification_ptr notification);
46 void subjectKilled(Observable *publisher);
47
48 // these functions are called when atoms are inserted or removed
49 virtual void AtomInserted(atomId_t) {};
50 virtual void AtomRemoved(atomId_t) {};
51
52 // functions to add atoms and bonds with ids relative to the parsed file
53 void resetIdAssociations();
54 void associateLocaltoGlobalId(const int local, const int global);
55 int getGlobalId(const int local) const;
56 int getLocalId(const int global) const;
57
58 std::pair<size_t, size_t> getMinMaxTrajectories(
59 const std::vector<const atom *> &_atoms) const;
60
61private:
62 //!> Output stream to write to when save() is called.
63 std::ostream* saveStream;
64
65 //!> typedef for atomic id-to-id map
66 typedef std::map<int, int> IdtoIdMap;
67
68 //!> Maps original atom IDs received from the parsed file to atom IDs in the world.
69 IdtoIdMap LocaltoGobalIdMap;
70
71 //!> Maps atom IDs in the World to those received from the parsed file.
72 IdtoIdMap GlobaltoLocalIdMap;
73};
74
75#endif /* FORMATPARSER_COMMON_HPP_ */
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