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Searched refs:pathRestraints (Results 1 – 4 of 4) sorted by relevance

/dports/science/coordgenlibs/coordgenlibs-3.0.0/
H A DCoordgenMacrocycleBuilder.h91 struct pathRestraints { struct
332 pathRestraints
359 int scorePathRestraints(pathRestraints& pr, Polyomino& p,
371 pathConstraints& pc, pathRestraints& pr) const;
383 pathRestraints& pr, int& bestP, int& bestScore,
388 bool matchPolyomino(Polyomino& p, pathConstraints& pc, pathRestraints& pr,
H A DCoordgenMacrocycleBuilder.cpp660 pathRestraints pr = getPathRestraints(atoms); in newMacrocycle()
1000 pathRestraints CoordgenMacrocycleBuilder::getPathRestraints( in getPathRestraints()
1003 pathRestraints pr; in getPathRestraints()
1063 pathRestraints& pr) const in scorePath()
1071 int CoordgenMacrocycleBuilder::scorePathRestraints(pathRestraints& pr, in scorePathRestraints()
1196 pathRestraints& pr, int& bestP, in matchPolyominoes()
1227 pathRestraints& pr, in matchPolyomino()
/dports/science/openbabel/openbabel-3.1.1/external/coordgen-master/coordgen/
H A DCoordgenMacrocycleBuilder.h91 struct pathRestraints { struct
332 pathRestraints
359 int scorePathRestraints(pathRestraints& pr, Polyomino& p,
371 pathConstraints& pc, pathRestraints& pr) const;
383 pathRestraints& pr, int& bestP, int& bestScore,
388 bool matchPolyomino(Polyomino& p, pathConstraints& pc, pathRestraints& pr,
H A DCoordgenMacrocycleBuilder.cpp658 pathRestraints pr = getPathRestraints(atoms); in newMacrocycle()
998 pathRestraints CoordgenMacrocycleBuilder::getPathRestraints( in getPathRestraints()
1001 pathRestraints pr; in getPathRestraints()
1061 pathRestraints& pr) const in scorePath()
1069 int CoordgenMacrocycleBuilder::scorePathRestraints(pathRestraints& pr, in scorePathRestraints()
1194 pathRestraints& pr, int& bestP, in matchPolyominoes()
1225 pathRestraints& pr, in matchPolyomino()