#include <O3AAlignMolecules.h>
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| LAP (unsigned int dim) |
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| ~LAP ()=default |
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int | getCost (const unsigned int i, const unsigned int j) |
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int | getRowSol (const unsigned int i) |
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void | computeMinCostPath (const int dim) |
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void | computeCostMatrix (const ROMol &prbMol, const MolHistogram &prbHist, const ROMol &refMol, const MolHistogram &refHist, O3AConstraintVect *o3aConstraintVect, int(*costFunc)(const unsigned int, const unsigned int, double, void *), void *data, const unsigned int n_bins=O3_MAX_H_BINS) |
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Definition at line 145 of file O3AAlignMolecules.h.
◆ LAP()
RDKit::MolAlign::LAP::LAP |
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unsigned int | dim | ) |
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◆ ~LAP()
RDKit::MolAlign::LAP::~LAP |
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default |
◆ computeCostMatrix()
void RDKit::MolAlign::LAP::computeCostMatrix |
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const ROMol & | prbMol, |
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const MolHistogram & | prbHist, |
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const ROMol & | refMol, |
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const MolHistogram & | refHist, |
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O3AConstraintVect * | o3aConstraintVect, |
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int(* | costFunc )(const unsigned int, const unsigned int, double, void *), |
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void * | data, |
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const unsigned int | n_bins = O3_MAX_H_BINS ) |
◆ computeMinCostPath()
void RDKit::MolAlign::LAP::computeMinCostPath |
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const int | dim | ) |
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◆ getCost()
int RDKit::MolAlign::LAP::getCost |
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const unsigned int | i, |
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const unsigned int | j ) |
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inline |
◆ getRowSol()
int RDKit::MolAlign::LAP::getRowSol |
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const unsigned int | i | ) |
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inline |
The documentation for this class was generated from the following file: