AtomTypeGrid

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Class Summary

class AtomTypeGrid
: public MoleculeGrid
{
public:
AtomTypeGrid(const Surface& surface, const float inDelta, const float maxRadius);
template< class MoleculeT> void markAtomTypes(const MoleculeT& M);
unsigned short getAtomType(const Vector3& point) const ;
protected:
}; // AtomTypeGrid

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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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AtomTypeGrid(const Surface& surface, const float inDelta, const float maxRadius);

  AtomTypeGrid(const Surface& surface, const float inDelta, const float maxRadius);

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template< class MoleculeT> void markAtomTypes(const MoleculeT& M);

  template< class MoleculeT>
  void markAtomTypes(const MoleculeT& M);

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unsigned short getAtomType(const Vector3& point) const ;

  unsigned short getAtomType(const Vector3& point) const                                                                                                                             
;

Function is currently defined inline.


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All Members

public:
AtomGrid(const Surface& surface, const float inDelta, const float maxRadius);
template< class MoleculeT> void markAtoms(const MoleculeT& M, float radius);
const vector< unsigned short>& getAtoms(const Vector3& point) const;
unsigned int getAtomsNumber(const Vector3& point) const;
template< class MoleculeT> void markAtomTypes(const MoleculeT& M);
unsigned short getAtomType(const Vector3& point) const ;
protected:

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Ancestors

Inheritance chain for AtomTypeGrid:

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Descendants

Class is not inherited by any others.

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