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PDBresidue.hh
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1 //
2 // ********************************************************************
3 // * License and Disclaimer *
4 // * *
5 // * The Geant4 software is copyright of the Copyright Holders of *
6 // * the Geant4 Collaboration. It is provided under the terms and *
7 // * conditions of the Geant4 Software License, included in the file *
8 // * LICENSE and available at http://cern.ch/geant4/license . These *
9 // * include a list of copyright holders. *
10 // * *
11 // * Neither the authors of this software system, nor their employing *
12 // * institutes,nor the agencies providing financial support for this *
13 // * work make any representation or warranty, express or implied, *
14 // * regarding this software system or assume any liability for its *
15 // * use. Please see the license in the file LICENSE and URL above *
16 // * for the full disclaimer and the limitation of liability. *
17 // * *
18 // * This code implementation is the result of the scientific and *
19 // * technical work of the GEANT4 collaboration. *
20 // * By using, copying, modifying or distributing the software (or *
21 // * any work based on the software) you agree to acknowledge its *
22 // * use in resulting scientific publications, and indicate your *
23 // * acceptance of all terms of the Geant4 Software license. *
24 // ********************************************************************
25 //
26 // This example is provided by the Geant4-DNA collaboration
27 // Any report or published results obtained using the Geant4-DNA software
28 // shall cite the following Geant4-DNA collaboration publication:
29 // Med. Phys. 37 (2010) 4692-4708
30 // Delage et al. PDB4DNA: implementation of DNA geometry from the Protein Data
31 // Bank (PDB) description for Geant4-DNA Monte-Carlo
32 // simulations (submitted to Comput. Phys. Commun.)
33 // The Geant4-DNA web site is available at http://geant4-dna.org
34 //
35 // --------------------------------------------------------------
36 // Authors: E. Delage
37 // november 2013
38 // --------------------------------------------------------------
39 //
40 //
43 
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45 
46 #ifndef RESIDUE_H
47 #define RESIDUE_H
48 
49 #include "PDBatom.hh"
50 
51 class Atom;
52 
54 
57 class Residue
58 {
59 public:
61  Residue();
63  Residue(const std::string& resName,int resSeq);
65  ~Residue() {};
66 
68  void Affiche();
70  Residue *GetNext();
72  Atom *GetFirst();
74  int GetID();
76  void SetNext(Residue *);
78  void SetFirst(Atom *);
79 
80  std::string fResName;
81  int fResSeq;
82  bool fVisible;
83  bool fSelected;
84  int fCenterX;
85  int fCenterY;
86  int fCenterZ;
87  int fNbAtom;
88 
89 private:
94 };
95 
96 #endif
97 
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