ResidueBBInfo (from ResiduesBuildingBlocks)

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Class Summary

class ResidueBBInfo

{
public:
ResidueBBInfo() ;
unsigned short size() const ;
unsigned short numOfGroups() const ;
unsigned short startAtomIndexOfGroup(unsigned short group) const ;
unsigned short type() const ;
REAL charge(unsigned short index) const ;
ATOM_TYPE type(unsigned short index) const ;
string name(unsigned short index) const ;
vector< unsigned short> chisAtomsIndeces() const;
void charges(REAL *charges) ;
void groups(int * groups) ;
void atomsTypes(ATOM_TYPE * types) ;
void chiTypes(int * chiTypes) ;
void atomsNames(char ** names) ;
void setChiAtomIndex(unsigned short position, unsigned short atomIndex) ;
static bool isBonded(int diff, int type1, int id1, int type2, int id2);
protected:
}; // ResidueBBInfo

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KEYWORD

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AUTHORS

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CHANGES LOG

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GOALS

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USAGE

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ResidueBBInfo() ;

for vector< ResidueBBInfo> initialization 

            ResidueBBInfo()                ;

Function is currently defined inline.


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unsigned short size() const ;

            unsigned short size() const                                               ;

Function is currently defined inline.


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unsigned short numOfGroups() const ;

            unsigned short numOfGroups() const                                                  ;

Function is currently defined inline.


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unsigned short startAtomIndexOfGroup(unsigned short group) const ;

            unsigned short startAtomIndexOfGroup(unsigned short group) const                                                        ;

Function is currently defined inline.


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unsigned short type() const ;

            unsigned short type() const                                                ;

Function is currently defined inline.


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REAL charge(unsigned short index) const ;

            REAL charge(unsigned short index) const                                                         ;

Function is currently defined inline.


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ATOM_TYPE type(unsigned short index) const ;

            ATOM_TYPE type(unsigned short index) const                                                        ;

Function is currently defined inline.


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string name(unsigned short index) const ;

            string name(unsigned short index) const                                                                ;

Function is currently defined inline.


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vector< unsigned short> chisAtomsIndeces() const;

            vector< unsigned short> chisAtomsIndeces() const;

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void charges(REAL *charges) ;

            void charges(REAL *charges)                                                     ;

Function is currently defined inline.


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void groups(int * groups) ;

            void groups(int * groups)                                                   ;

Function is currently defined inline.


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void atomsTypes(ATOM_TYPE * types) ;

            void atomsTypes(ATOM_TYPE * types)                                                  ;

Function is currently defined inline.


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void chiTypes(int * chiTypes) ;

            void chiTypes(int * chiTypes)                                                       ;

Function is currently defined inline.


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void atomsNames(char ** names) ;

            void atomsNames(char ** names)                                                  ;

Function is currently defined inline.


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void setChiAtomIndex(unsigned short position, unsigned short atomIndex) ;

            void setChiAtomIndex(unsigned short position, unsigned short atomIndex)                                                                    ;

Function is currently defined inline.


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bool isBonded(int diff, int type1, int id1, int type2, int id2);

        inline static bool isBonded(int diff, int type1, int id1, int type2, int id2);

Function is currently defined inline.


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All Members

public:
unsigned short size() const ;
unsigned short numOfGroups() const ;
unsigned short startAtomIndexOfGroup(unsigned short group) const ;
unsigned short type() const ;
REAL charge(unsigned short index) const ;
ATOM_TYPE type(unsigned short index) const ;
string name(unsigned short index) const ;
vector< unsigned short> chisAtomsIndeces() const;
void charges(REAL *charges) ;
void groups(int * groups) ;
void atomsTypes(ATOM_TYPE * types) ;
void chiTypes(int * chiTypes) ;
void atomsNames(char ** names) ;
void setChiAtomIndex(unsigned short position, unsigned short atomIndex) ;
static bool isBonded(int diff, int type1, int id1, int type2, int id2);
protected:

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Ancestors

Class does not inherit from any other class.

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Descendants

Class is not inherited by any others.

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Generated from source by the Cocoon utilities on Mon Dec 21 12:00:24 2009 .

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