source: src/AtomicInfo.cpp@ c38826

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Last change on this file since c38826 was bcf653, checked in by Frederik Heber <heber@…>, 14 years ago

Added copyright note to each .cpp file and an extensive one to builder.cpp.

  • Property mode set to 100644
File size: 1.6 KB
Line 
1/*
2 * Project: MoleCuilder
3 * Description: creates and alters molecular systems
4 * Copyright (C) 2010 University of Bonn. All rights reserved.
5 * Please see the LICENSE file or "Copyright notice" in builder.cpp for details.
6 */
7
8/*
9 * AtomicInfo.cpp
10 *
11 * Created on: Aug 10, 2010
12 * Author: heber
13 */
14
15#include "atom.hpp"
16#include "AtomicInfo.hpp"
17#include "element.hpp"
18#include "LinearAlgebra/Vector.hpp"
19
20/********************************** Functions for class AtomicInfo **********************************/
21
22AtomicInfo::AtomicInfo() :
23 Type(NULL),
24 Father(NULL),
25 Id(-1)
26{}
27AtomicInfo::AtomicInfo(const atom &_atom) :
28 Position(_atom.getPosition()),
29 Type(_atom.getType()),
30 Velocity(_atom.AtomicVelocity),
31 Father(_atom.father),
32 Mol(_atom.getMolecule()),
33 Id(_atom.getId())
34{}
35
36AtomicInfo::~AtomicInfo()
37{}
38
39
40bool AtomicInfo::setAtom(atom &_atom) const
41{
42 _atom.setPosition(Position);
43 _atom.setType(Type);
44 _atom.father = const_cast<atom *>(Father); // TODO: Actually, atom::father should be const atom *!
45 _atom.setMolecule(const_cast<molecule *>(Mol)); // this is ok, mol is const within AtomicInfo, but not outside (atoms need to register)
46 _atom.AtomicVelocity = Velocity;
47 if (_atom.getId() == Id)
48 return true;
49 else
50 return (_atom.changeId(Id));
51}
52
53atomId_t AtomicInfo::getId() const {
54 return Id;
55}
56
57AtomicInfo& AtomicInfo::operator=(const AtomicInfo& AI)
58{
59 if (&AI == this) // check self-assignment
60 return *this;
61 Position = AI.Position;
62 Type = AI.Type;
63 Father = AI.Father;
64 Mol = AI.Mol;
65 Velocity = AI.Velocity;
66 Id = AI.Id;
67 return *this;
68}
69
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