magnes::RingPerceptor Class Reference

Implementation of a ring perception algorithm. More...

#include <ringperceptor.h>

Public Member Functions
	RingPerceptor (const magnes::Molecule *molecule)
	RingPerceptor (const magnes::Frame *frame)
std::vector< std::vector< size_t > >	Rings (size_t size=0)

Detailed Description

Implementation of a ring perception algorithm.

Implementation of the ring perception algorithm of Hansser et al J. Chem. Inf. Comput. Sci. 1996, 36, 1146-1152

Member Function Documentation

Rings()

std::vector< std::vector<size_t> > magnes::RingPerceptor::Rings

(

size_t

size = 0

)

Returns

a vector with the ring paths*

Parameters

size	if size==0 return all rings

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The documentation for this class was generated from the following file:

• /Users/armando/worksrc/magnes-code/trunk/magnes/core/ringperceptor.h