Chemical Data Processing Library C++ API - Version 1.4.0
FeatureProperty.hpp
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1 /*
2  * FeatureProperty.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_PHARM_FEATUREPROPERTY_HPP
30 #define CDPL_PHARM_FEATUREPROPERTY_HPP
31 
32 #include "CDPL/Pharm/APIPrefix.hpp"
33 
34 
35 namespace CDPL
36 {
37 
38  namespace Base
39  {
40 
41  class LookupKey;
42  }
43 
44  namespace Pharm
45  {
46 
50  namespace FeatureProperty
51  {
52 
58  extern CDPL_PHARM_API const Base::LookupKey TYPE;
59 
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122 
130 
131  } // namespace FeatureProperty
132  } // namespace Pharm
133 } // namespace CDPL
134 
135 #endif // CDPL_PHARM_FEATUREPROPERTY_HPP
Definition of the preprocessor macro CDPL_PHARM_API.
#define CDPL_PHARM_API
Tells the compiler/linker which classes, functions and variables are part of the library API.
Unique lookup key for control-parameter and property values.
Definition: LookupKey.hpp:54
CDPL_PHARM_API const Base::LookupKey WEIGHT
Specifies the weight (relative importance) of the feature.
CDPL_PHARM_API const Base::LookupKey TOLERANCE
Specifies the positional tolerance of the feature.
CDPL_PHARM_API const Base::LookupKey SUBSTRUCTURE
Specifies the chemical substructure the feature was derived from.
CDPL_PHARM_API const Base::LookupKey LENGTH
Specifies the length of the feature (for directional features).
CDPL_PHARM_API const Base::LookupKey GEOMETRY
Specifies the geometric shape of the feature (see namespace Pharm::FeatureGeometry).
CDPL_PHARM_API const Base::LookupKey DISABLED_FLAG
Specifies whether the feature is currently disabled (and thus not considered in pharmacophore matchin...
CDPL_PHARM_API const Base::LookupKey OPTIONAL_FLAG
Specifies whether the feature is optional in pharmacophore matching.
CDPL_PHARM_API const Base::LookupKey ENVIRONMENT_SUBSTRUCTURE
Specifies the environment substructure (e.g. interacting pocket residues) associated with the feature...
CDPL_PHARM_API const Base::LookupKey ORIENTATION
Specifies the orientation of the feature in 3D space.
CDPL_PHARM_API const Base::LookupKey TYPE
Specifies the type of the pharmacophore feature (see namespace Pharm::FeatureType).
CDPL_PHARM_API const Base::LookupKey HYDROPHOBICITY
Specifies the calculated hydrophobicity contribution of the feature.
The namespace of the Chemical Data Processing Library.