#include <MolFileIOData.hh>
core::chemical::sdf::MolFileIOAtom::MolFileIOAtom |
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core::chemical::sdf::MolFileIOAtom::~MolFileIOAtom |
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virtual |
std::string const& core::chemical::sdf::MolFileIOAtom::element |
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const |
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inline |
void core::chemical::sdf::MolFileIOAtom::element |
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std::string const & |
element | ) |
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inline |
int core::chemical::sdf::MolFileIOAtom::formal_charge |
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const |
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inline |
void core::chemical::sdf::MolFileIOAtom::formal_charge |
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int |
formal_charge | ) |
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inline |
AtomIndex core::chemical::sdf::MolFileIOAtom::index |
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const |
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inline |
void core::chemical::sdf::MolFileIOAtom::index |
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AtomIndex |
index | ) |
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inline |
std::string const& core::chemical::sdf::MolFileIOAtom::name |
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const |
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inline |
void core::chemical::sdf::MolFileIOAtom::name |
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std::string const & |
name | ) |
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inline |
core::Real core::chemical::sdf::MolFileIOAtom::partial_charge |
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const |
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inline |
void core::chemical::sdf::MolFileIOAtom::partial_charge |
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core::Real |
partial_charge | ) |
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inline |
Vector const& core::chemical::sdf::MolFileIOAtom::position |
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const |
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inline |
void core::chemical::sdf::MolFileIOAtom::position |
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Vector const & |
position | ) |
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inline |
std::string core::chemical::sdf::MolFileIOAtom::element_ |
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private |
int core::chemical::sdf::MolFileIOAtom::formal_charge_ |
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private |
AtomIndex core::chemical::sdf::MolFileIOAtom::index_ |
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private |
std::string core::chemical::sdf::MolFileIOAtom::name_ |
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private |
core::Real core::chemical::sdf::MolFileIOAtom::partial_charge_ |
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private |
Vector core::chemical::sdf::MolFileIOAtom::position_ |
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private |
The documentation for this class was generated from the following files: