EnumerationStrategyBase.h File Reference

#include <RDGeneral/export.h>
#include "EnumerateTypes.h"
#include "../Reaction.h"
#include <utility>
#include <vector>
#include <RDGeneral/BoostStartInclude.h>
#include <cstdint>
#include <RDGeneral/BoostEndInclude.h>
#include <GraphMol/RDKitBase.h>

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Classes
class	RDKit::EnumerationStrategyException
	class for flagging enumeration strategy errors More...
class	RDKit::EnumerationStrategyBase

Namespaces
namespace	RDKit
	Std stuff.

Functions
template<class T>
EnumerationTypes::RGROUPS	RDKit::getSizesFromBBs (const std::vector< std::vector< T > > &bbs)
	Return the number of elements per input vector.
RDKIT_CHEMREACTIONS_EXPORT EnumerationTypes::RGROUPS	RDKit::getSizesFromReactants (const std::vector< MOL_SPTR_VECT > &bbs)
RDKIT_CHEMREACTIONS_EXPORT MOL_SPTR_VECT	RDKit::getReactantsFromRGroups (const std::vector< MOL_SPTR_VECT > &bbs, const EnumerationTypes::RGROUPS &rgroups)
RDKIT_CHEMREACTIONS_EXPORT boost::uint64_t	RDKit::computeNumProducts (const EnumerationTypes::RGROUPS &sizes)