RDKit
Open-source cheminformatics and machine learning.
MolWriters.h File Reference
#include <RDGeneral/types.h>
#include <string>
#include <iostream>
#include <GraphMol/ROMol.h>

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Classes

class  RDKit::MolWriter
class  RDKit::SmilesWriter
class  RDKit::SDWriter
class  RDKit::TDTWriter
class  RDKit::PDBWriter

Namespaces

namespace  RDKit
 

Includes a bunch of functionality for handling Atom and Bond queries.


Variables

static int RDKit::defaultConfId = -1
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