00001 // 00002 // Copyright (C) 2004-2008 Greg Landrum and Rational Discovery LLC 00003 // 00004 // @@ All Rights Reserved @@ 00005 // 00006 #ifndef __CHEMICALFEATURE_H_11012005_1310__ 00007 #define __CHEMICALFEATURE_H_11012005_1310__ 00008 00009 #include <Geometry/point.h> 00010 namespace ChemicalFeatures { 00011 00012 //------------------------------------------------------------------ 00013 //! abstract base class for chemical feature 00014 class ChemicalFeature { 00015 public: 00016 ChemicalFeature() {}; 00017 virtual ~ChemicalFeature() {}; 00018 00019 // returns the type of the feature 00020 virtual const std::string& getType() const = 0; 00021 00022 // returns the family of the feature 00023 virtual const std::string& getFamily() const = 0; 00024 00025 // returns the position of the feature 00026 virtual RDGeom::Point3D getPos() const = 0; 00027 }; 00028 } 00029 00030 #endif 00031
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