OpenStructure
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#include <filter_clashes.hh>
Public Member Functions | |
StereoChemicalBondViolation () | |
StereoChemicalBondViolation (const UniqueAtomIdentifier &atom1, const UniqueAtomIdentifier &atom2, Real mdl_value, std::pair< Real, Real > allowed_range) | |
UniqueAtomIdentifier | GetFirstAtom () const |
UniqueAtomIdentifier | GetSecondAtom () const |
Real | GetBondLength () const |
std::pair< Real, Real > | GetAllowedRange () const |
Definition at line 79 of file filter_clashes.hh.
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Definition at line 82 of file filter_clashes.hh.
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inline |
Definition at line 84 of file filter_clashes.hh.
Definition at line 91 of file filter_clashes.hh.
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Definition at line 90 of file filter_clashes.hh.
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Definition at line 88 of file filter_clashes.hh.
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Definition at line 89 of file filter_clashes.hh.