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RDKit
Open-source cheminformatics and machine learning.
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Functions | |
void | drawLine (std::vector< ElementType > &res, int atnum1, int atnum2, int lineWidth, int dashed, double x1, double y1, double x2, double y2) |
std::pair< std::string, OrientType > | getAtomSymbolAndOrientation (const Atom &atom, RDGeom::Point2D nbrSum) |
void RDKit::Drawing::detail::drawLine | ( | std::vector< ElementType > & | res, |
int | atnum1, | ||
int | atnum2, | ||
int | lineWidth, | ||
int | dashed, | ||
double | x1, | ||
double | y1, | ||
double | x2, | ||
double | y2 | ||
) |
Definition at line 57 of file MolDrawing.h.
References RDKit::Drawing::LINE.
Referenced by RDKit::MolDraw2D::atomSyms(), RDKit::Drawing::DrawingToSVG(), RDKit::Drawing::DrawMol(), and RDKit::MolDraw2D::lineWidth().
std::pair<std::string,OrientType> RDKit::Drawing::detail::getAtomSymbolAndOrientation | ( | const Atom & | atom, |
RDGeom::Point2D | nbrSum | ||
) |
Definition at line 73 of file MolDrawing.h.
References RDKit::Drawing::C, RDKit::Drawing::E, RDKit::Atom::getAtomicNum(), RDKit::Atom::getDegree(), RDKit::Atom::getFormalCharge(), RDKit::Atom::getIsotope(), RDKit::Atom::getNumRadicalElectrons(), RDKit::Atom::getProp(), RDKit::Atom::getSymbol(), RDKit::Atom::getTotalNumHs(), RDKit::Atom::hasProp(), RDKit::common_properties::molAtomMapNumber, RDKit::Drawing::N, RDKit::Drawing::S, RDKit::Drawing::W, RDGeom::Point2D::x, and RDGeom::Point2D::y.
Referenced by RDKit::MolDraw2D::atomSyms(), and RDKit::Drawing::DrawMol().