Chemical Data Processing Library C++ API - Version 1.1.1
BondPropertyFlag.hpp
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1 /*
2  * BondPropertyFlag.hpp
3  *
4  * This file is part of the Chemical Data Processing Toolkit
5  *
6  * Copyright (C) 2003 Thomas Seidel <thomas.seidel@univie.ac.at>
7  *
8  * This library is free software; you can redistribute it and/or
9  * modify it under the terms of the GNU Lesser General Public
10  * License as published by the Free Software Foundation; either
11  * version 2 of the License, or (at your option) any later version.
12  *
13  * This library is distributed in the hope that it will be useful,
14  * but WITHOUT ANY WARRANTY; without even the implied warranty of
15  * MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the GNU
16  * Lesser General Public License for more details.
17  *
18  * You should have received a copy of the GNU Lesser General Public License
19  * along with this library; see the file COPYING. If not, write to
20  * the Free Software Foundation, Inc., 59 Temple Place - Suite 330,
21  * Boston, MA 02111-1307, USA.
22  */
23 
29 #ifndef CDPL_CHEM_BONDPROPERTYFLAG_HPP
30 #define CDPL_CHEM_BONDPROPERTYFLAG_HPP
31 
32 
33 namespace CDPL
34 {
35 
36  namespace Chem
37  {
38 
42  namespace BondPropertyFlag
43  {
44 
48  const unsigned int NONE = 0x0;
49 
53  const unsigned int DEFAULT = 0x80000000;
54 
58  const unsigned int CIP_CONFIGURATION = 0x1;
59 
63  const unsigned int ORDER = 0x2;
64 
68  const unsigned int TOPOLOGY = 0x4;
69 
73  const unsigned int AROMATICITY = 0x8;
74 
78  const unsigned int CONFIGURATION = 0x10;
79  } // namespace BondPropertyFlag
80  } // namespace Chem
81 } // namespace CDPL
82 
83 #endif // CDPL_CHEM_BONDPROPERTYFLAG_HPP
CDPL::Chem::BondPropertyFlag::AROMATICITY
const unsigned int AROMATICITY
Specifies the membership of a bond in aromatic rings.
Definition: BondPropertyFlag.hpp:73
CDPL::Chem::BondPropertyFlag::CONFIGURATION
const unsigned int CONFIGURATION
Specifies the steric configuration of a double bond.
Definition: BondPropertyFlag.hpp:78
CDPL::Chem::BondPropertyFlag::CIP_CONFIGURATION
const unsigned int CIP_CONFIGURATION
Specifies the CIP-configuration of a double bond.
Definition: BondPropertyFlag.hpp:58
CDPL::Chem::BondPropertyFlag::ORDER
const unsigned int ORDER
Specifies the order of a bond.
Definition: BondPropertyFlag.hpp:63
CDPL::Chem::BondPropertyFlag::NONE
const unsigned int NONE
Represents an empty set of bond properties.
Definition: BondPropertyFlag.hpp:48
CDPL::Chem::BondPropertyFlag::TOPOLOGY
const unsigned int TOPOLOGY
Specifies the ring/chain topology of a bond.
Definition: BondPropertyFlag.hpp:68
CDPL
The namespace of the Chemical Data Processing Library.
CDPL::Chem::BondPropertyFlag::DEFAULT
const unsigned int DEFAULT
Represents the default set of bond properties.
Definition: BondPropertyFlag.hpp:53