RDKit
Open-source cheminformatics and machine learning.
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AtomFeat.h File Reference
#include <RDGeneral/export.h>

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Namespaces

namespace  RDKit
 Std stuff.
 
namespace  RDKit::Descriptors
 

Functions

RDKIT_DESCRIPTORS_EXPORT void RDKit::Descriptors::AtomFeatVect (const ROMol &, std::vector< double > &res, int atomid=0, bool addchiral=false)
 

Variables

const std::string RDKit::Descriptors::AtomFeatVersion = "1.0.0"