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33 lines
852 B
C++
33 lines
852 B
C++
// $Id: granthamChemicalDistances.h 962 2006-11-07 15:13:34Z privmane $
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#ifndef ___GRANTHAM_CHEMICAL_DISTANCES
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#define ___GRANTHAM_CHEMICAL_DISTANCES
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#include "definitions.h"
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class granthamChemicalDistances {
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public:
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explicit granthamChemicalDistances();
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MDOUBLE getGranthamDistance(const int aa1,const int aa2) const ;
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MDOUBLE getGranthamPolarityDistance(const int aa1,const int aa2) const;
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MDOUBLE getGranthamPolarity(const int aa1) const;
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virtual ~granthamChemicalDistances() {}
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MDOUBLE getHughesChargeDistance(const int aa1,const int aa2) const;// page 520
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MDOUBLE getHughesPolarityDistance(const int aa1,const int aa2) const;// page 520
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MDOUBLE getHughesHydrophobicityDistance(const int aa1,const int aa2) const;// page 520
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private:
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// private members:
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MDOUBLE GranChemDist[20][20];
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MDOUBLE GranPolarityTable[20];
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};
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#endif
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