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Open-source cheminformatics and machine learning.
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Namespaces | Variables
MaestroProperties.h File Reference
#include <string>

Go to the source code of this file.

Namespaces

namespace  RDKit
 Std stuff.
 
namespace  RDKit::FileParsers
 
namespace  RDKit::FileParsers::schrodinger
 

Variables

static const std::string MAE_ATOM_TYPE = "i_m_mmod_type"
 
static const std::string MAE_BOND_DATIVE_MARK = "b_sPrivate_dative_bond"
 
static const std::string MAE_BOND_PARITY = "i_sd_original_parity"
 
static const std::string MAE_ENHANCED_STEREO_STATUS
 
static const std::string MAE_RGROUP_LABEL = "i_sd__MolFileRLabel"
 
static const std::string MAE_STEREO_STATUS = "i_m_ct_stereo_status"
 
static const std::string PDB_ATOM_NAME = "s_m_pdb_atom_name"
 
static const std::string PDB_CHAIN_NAME = "s_m_chain_name"
 
static const std::string PDB_INSERTION_CODE = "s_m_insertion_code"
 
static const std::string PDB_OCCUPANCY = "r_m_pdb_occupancy"
 
static const std::string PDB_RESIDUE_NAME = "s_m_pdb_residue_name"
 
static const std::string PDB_RESIDUE_NUMBER = "i_m_residue_number"
 
static const std::string PDB_TFACTOR = "r_m_pdb_tfactor"
 

Variable Documentation

◆ MAE_ATOM_TYPE

const std::string MAE_ATOM_TYPE = "i_m_mmod_type"
static

Definition at line 16 of file MaestroProperties.h.

◆ MAE_BOND_DATIVE_MARK

const std::string MAE_BOND_DATIVE_MARK = "b_sPrivate_dative_bond"
static

Definition at line 17 of file MaestroProperties.h.

◆ MAE_BOND_PARITY

const std::string MAE_BOND_PARITY = "i_sd_original_parity"
static

Definition at line 18 of file MaestroProperties.h.

◆ MAE_ENHANCED_STEREO_STATUS

const std::string MAE_ENHANCED_STEREO_STATUS
static
Initial value:
=
"i_m_ct_enhanced_stereo_status"

Definition at line 19 of file MaestroProperties.h.

◆ MAE_RGROUP_LABEL

const std::string MAE_RGROUP_LABEL = "i_sd__MolFileRLabel"
static

Definition at line 21 of file MaestroProperties.h.

◆ MAE_STEREO_STATUS

const std::string MAE_STEREO_STATUS = "i_m_ct_stereo_status"
static

Definition at line 22 of file MaestroProperties.h.

◆ PDB_ATOM_NAME

const std::string PDB_ATOM_NAME = "s_m_pdb_atom_name"
static

Definition at line 23 of file MaestroProperties.h.

◆ PDB_CHAIN_NAME

const std::string PDB_CHAIN_NAME = "s_m_chain_name"
static

Definition at line 24 of file MaestroProperties.h.

◆ PDB_INSERTION_CODE

const std::string PDB_INSERTION_CODE = "s_m_insertion_code"
static

Definition at line 25 of file MaestroProperties.h.

◆ PDB_OCCUPANCY

const std::string PDB_OCCUPANCY = "r_m_pdb_occupancy"
static

Definition at line 26 of file MaestroProperties.h.

◆ PDB_RESIDUE_NAME

const std::string PDB_RESIDUE_NAME = "s_m_pdb_residue_name"
static

Definition at line 27 of file MaestroProperties.h.

◆ PDB_RESIDUE_NUMBER

const std::string PDB_RESIDUE_NUMBER = "i_m_residue_number"
static

Definition at line 28 of file MaestroProperties.h.

◆ PDB_TFACTOR

const std::string PDB_TFACTOR = "r_m_pdb_tfactor"
static

Definition at line 29 of file MaestroProperties.h.