RMSDConformerSelector.hpp File Reference

Definition of the class CDPL::ConfGen::RMSDConformerSelector. More...

#include <vector>
#include <cstddef>
#include <unordered_map>
#include "CDPL/ConfGen/APIPrefix.hpp"
#include "CDPL/ConfGen/CallbackFunction.hpp"
#include "CDPL/Chem/Fragment.hpp"
#include "CDPL/Chem/StereoDescriptor.hpp"
#include "CDPL/Chem/AutomorphismGroupSearch.hpp"
#include "CDPL/Util/BitSet.hpp"
#include "CDPL/Util/ObjectStack.hpp"
#include "CDPL/Util/ObjectPool.hpp"
#include "CDPL/Math/VectorArray.hpp"
#include "CDPL/Math/VectorArrayAlignmentCalculator.hpp"

Go to the source code of this file.

Classes
class	CDPL::ConfGen::RMSDConformerSelector

Namespaces
	CDPL
	The namespace of the Chemical Data Processing Library.
	CDPL::ConfGen
	Contains classes and functions related to conformer ensemble generation.

Detailed Description

Definition of the class CDPL::ConfGen::RMSDConformerSelector.