rdkit.Chem.rdMolProcessing module¶

Module containing functions for working with groups of molecules

class rdkit.Chem.rdMolProcessing.SupplierOptions(self)¶

Bases: object

Supplier Options

property confId2D¶: used for TDT files

property confId3D¶: used for TDT files

property delimiter¶: used for SMILES files

property nameColumn¶: used for SMILES files

property nameRecord¶: used for TDT files

property numThreads¶: the number of threads to use while working

property removeHs¶: (self) -> bool

property sanitize¶: (self) -> bool

property smilesColumn¶: used for SMILES files

property strictParsing¶: (self) -> bool

property titleLine¶: used for SMILES files