BALL 1.5.0
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#include <BALL/MOLMEC/MMFF94/MMFF94Parameters.h>
Public Member Functions | |
MMFF94ParametersBase () | |
Default constructor. | |
virtual | ~MMFF94ParametersBase () |
Destructor. | |
const MMFF94ParametersBase & | operator= (const MMFF94ParametersBase &) |
Assignment operator. | |
virtual void | clear () |
Clear method. | |
bool | isInitialized () |
bool | readParameters (Parameters &p, const String §ion) |
void | setEquivalences (const MMFF94AtomTypeEquivalences &equi) |
Protected Member Functions | |
virtual bool | setup_ (const std::vector< std::vector< String > > &) |
Protected Attributes | |
bool | is_initialized_ |
Size | number_expected_fields_ |
const MMFF94AtomTypeEquivalences * | equiv_ |
MMFF94 component parameters base class
Definition at line 39 of file MMFF94Parameters.h.
BALL::MMFF94ParametersBase::MMFF94ParametersBase | ( | ) |
Default constructor.
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inlinevirtual |
Destructor.
Definition at line 49 of file MMFF94Parameters.h.
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virtual |
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inline |
Definition at line 60 of file MMFF94Parameters.h.
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inline |
Assignment operator.
Definition at line 52 of file MMFF94Parameters.h.
bool BALL::MMFF94ParametersBase::readParameters | ( | Parameters & | p, |
const String & | section ) |
BALL::Exception::FileNotFound |
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inline |
Definition at line 66 of file MMFF94Parameters.h.
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inlineprotectedvirtual |
Reimplemented in BALL::MMFF94AtomTypeEquivalences, BALL::MMFF94AtomTypes, BALL::MMFF94BendParameters, BALL::MMFF94ESParameters, BALL::MMFF94PlaneParameters, BALL::MMFF94StretchBendParameters, BALL::MMFF94StretchParameters, BALL::MMFF94TorsionParameters, and BALL::MMFF94VDWParameters.
Definition at line 70 of file MMFF94Parameters.h.
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protected |
Definition at line 76 of file MMFF94Parameters.h.
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protected |
Definition at line 72 of file MMFF94Parameters.h.
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protected |
Definition at line 75 of file MMFF94Parameters.h.