#include <MMFF94SymbolicToNumericAtomTypeMap.hpp>
◆ SharedPointer
◆ ConstEntryIterator
◆ EntryIterator
◆ Entry
◆ MMFF94SymbolicToNumericAtomTypeMap()
CDPL::ForceField::MMFF94SymbolicToNumericAtomTypeMap::MMFF94SymbolicToNumericAtomTypeMap |
( |
| ) |
|
◆ addEntry()
void CDPL::ForceField::MMFF94SymbolicToNumericAtomTypeMap::addEntry |
( |
const std::string & |
sym_type, |
|
|
unsigned int |
num_type |
|
) |
| |
◆ getEntry()
unsigned int CDPL::ForceField::MMFF94SymbolicToNumericAtomTypeMap::getEntry |
( |
const std::string & |
sym_type | ) |
const |
◆ clear()
void CDPL::ForceField::MMFF94SymbolicToNumericAtomTypeMap::clear |
( |
| ) |
|
◆ getNumEntries()
std::size_t CDPL::ForceField::MMFF94SymbolicToNumericAtomTypeMap::getNumEntries |
( |
| ) |
const |
◆ removeEntry() [1/2]
bool CDPL::ForceField::MMFF94SymbolicToNumericAtomTypeMap::removeEntry |
( |
const std::string & |
sym_type | ) |
|
◆ removeEntry() [2/2]
◆ getEntriesBegin() [1/2]
ConstEntryIterator CDPL::ForceField::MMFF94SymbolicToNumericAtomTypeMap::getEntriesBegin |
( |
| ) |
const |
◆ getEntriesEnd() [1/2]
ConstEntryIterator CDPL::ForceField::MMFF94SymbolicToNumericAtomTypeMap::getEntriesEnd |
( |
| ) |
const |
◆ getEntriesBegin() [2/2]
EntryIterator CDPL::ForceField::MMFF94SymbolicToNumericAtomTypeMap::getEntriesBegin |
( |
| ) |
|
◆ getEntriesEnd() [2/2]
EntryIterator CDPL::ForceField::MMFF94SymbolicToNumericAtomTypeMap::getEntriesEnd |
( |
| ) |
|
◆ begin() [1/2]
◆ end() [1/2]
◆ begin() [2/2]
EntryIterator CDPL::ForceField::MMFF94SymbolicToNumericAtomTypeMap::begin |
( |
| ) |
|
◆ end() [2/2]
EntryIterator CDPL::ForceField::MMFF94SymbolicToNumericAtomTypeMap::end |
( |
| ) |
|
◆ load()
void CDPL::ForceField::MMFF94SymbolicToNumericAtomTypeMap::load |
( |
std::istream & |
is | ) |
|
◆ loadDefaults()
void CDPL::ForceField::MMFF94SymbolicToNumericAtomTypeMap::loadDefaults |
( |
| ) |
|
◆ set()
static void CDPL::ForceField::MMFF94SymbolicToNumericAtomTypeMap::set |
( |
const SharedPointer & |
map | ) |
|
|
static |
◆ get()
static const SharedPointer& CDPL::ForceField::MMFF94SymbolicToNumericAtomTypeMap::get |
( |
| ) |
|
|
static |
The documentation for this class was generated from the following file: