source: src/Atom/AtomicInfo.hpp@ ce7bfd

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Last change on this file since ce7bfd was 560bbe, checked in by Frederik Heber <heber@…>, 14 years ago

AtomicInfo now also (re)stores ParticleInfo::Nr, molecule has own IdPool.

  • molecule now also has an internal IdPool to be able to hand out unique ids, according to uniqueId policy.
  • new functions: molecule::changeAtomNr(), molecule::setAtomName()
  • molecule::erase() and ::insert() release and set the id (and the name).
  • molecule::setAtomName() uses getNr() with id increased by one.
  • AtomicInfo stores and sets ParticleInfo::Nr.
  • atom::changeNr() is similar to changeId() only for the molecule.
  • molecule::AddAtom() does not set the name anymore, is done by ::insert().
  • simplified molecule::doCountAtoms() a lot, no more naming of atoms.
  • SPEEDUP: This speeds up the GUI already a lot.
  • TESTFIX: changed regression test Tesselation/BigNonConvex due to different ordering of node ids (due to above), surface is still the same (checked).
  • Property mode set to 100644
File size: 776 bytes
RevLine 
[e41c48]1/*
2 * AtomicInfo.hpp
3 *
4 * Created on: Aug 10, 2010
5 * Author: heber
6 */
7
8#ifndef ATOMICINFO_HPP_
9#define ATOMICINFO_HPP_
10
[56f73b]11// include config.h
12#ifdef HAVE_CONFIG_H
13#include <config.h>
14#endif
15
16
[e41c48]17class atom;
18class element;
19class molecule;
20class Vector;
21
22/** This is for storing and transfering the information contained within an atom.
23 * This is needed for Undo/Redo operations of AtomActions.
24 */
25class AtomicInfo {
26public:
27 AtomicInfo();
28 AtomicInfo(const atom &_atom);
29 ~AtomicInfo();
30
31 bool setAtom(atom &_atom) const;
32 atomId_t getId() const;
33
34 AtomicInfo& operator=(const AtomicInfo&);
35
36private:
37 Vector Position;
38 const element * Type;
39 Vector Velocity;
[3867a7]40 atomId_t FatherId;
41 moleculeId_t MolId;
[e41c48]42 atomId_t Id;
[560bbe]43 int Nr;
[e41c48]44};
45
46
47#endif /* ATOMICINFO_HPP_ */
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