RDKit
Open-source cheminformatics and machine learning.
Loading...
Searching...
No Matches
details.h File Reference
#include <RDGeneral/export.h>
#include <GraphMol/Atom.h>
#include <GraphMol/Bond.h>
#include <GraphMol/StereoGroup.h>

Go to the source code of this file.

Namespaces

namespace  RDKit
 Std stuff.
namespace  RDKit::MolInterchange

Variables

constexpr int RDKit::MolInterchange::currentMolJSONVersion = 10
constexpr int RDKit::MolInterchange::currentRDKitJSONVersion = 12
constexpr int RDKit::MolInterchange::currentRDKitRepresentationVersion = 2
constexpr int RDKit::MolInterchange::currentChargeRepresentationVersion = 10
constexpr int RDKit::MolInterchange::currentQueryRepresentationVersion = 10
static const std::map< std::string, Atom::ChiralTypeRDKit::MolInterchange::chilookup
static const std::map< Atom::ChiralType, std::string > RDKit::MolInterchange::inv_chilookup
static const std::map< unsigned int, Bond::BondTypeRDKit::MolInterchange::bolookup
static const std::map< Bond::BondType, unsigned int > RDKit::MolInterchange::inv_bolookup
static const std::map< std::string, Bond::BondStereoRDKit::MolInterchange::stereoBondlookup
static const std::map< Bond::BondStereo, std::string > RDKit::MolInterchange::inv_stereoBondlookup
static const std::map< std::string, StereoGroupTypeRDKit::MolInterchange::stereoGrouplookup
static const std::map< StereoGroupType, std::string > RDKit::MolInterchange::inv_stereoGrouplookup