![]() |
RDKit
Open-source cheminformatics and machine learning.
|
#include <MolDraw2D.h>
Public Member Functions | |
MolDrawOptions () | |
Definition at line 115 of file MolDraw2D.h.
|
inline |
Definition at line 192 of file MolDraw2D.h.
References RDKit::assignDefaultPalette().
bool RDKit::MolDrawOptions::addAtomIndices = false |
Definition at line 182 of file MolDraw2D.h.
bool RDKit::MolDrawOptions::addBondIndices = false |
Definition at line 183 of file MolDraw2D.h.
double RDKit::MolDrawOptions::additionalAtomLabelPadding = 0.0 |
Definition at line 148 of file MolDraw2D.h.
bool RDKit::MolDrawOptions::addStereoAnnotation = false |
Definition at line 185 of file MolDraw2D.h.
double RDKit::MolDrawOptions::annotationFontScale = 0.75 |
Definition at line 140 of file MolDraw2D.h.
ColourPalette RDKit::MolDrawOptions::atomColourPalette |
Definition at line 164 of file MolDraw2D.h.
bool RDKit::MolDrawOptions::atomHighlightsAreCircles = false |
Definition at line 186 of file MolDraw2D.h.
bool RDKit::MolDrawOptions::atomLabelDeuteriumTritium |
Definition at line 116 of file MolDraw2D.h.
std::map<int, std::string> RDKit::MolDrawOptions::atomLabels |
Definition at line 151 of file MolDraw2D.h.
std::vector<std::vector<int> > RDKit::MolDrawOptions::atomRegions |
Definition at line 152 of file MolDraw2D.h.
DrawColour RDKit::MolDrawOptions::backgroundColour |
Definition at line 134 of file MolDraw2D.h.
int RDKit::MolDrawOptions::bondLineWidth = -1 |
Definition at line 155 of file MolDraw2D.h.
bool RDKit::MolDrawOptions::centreMoleculesBeforeDrawing = false |
Definition at line 189 of file MolDraw2D.h.
bool RDKit::MolDrawOptions::circleAtoms = true |
Definition at line 119 of file MolDraw2D.h.
bool RDKit::MolDrawOptions::clearBackground = true |
Definition at line 132 of file MolDraw2D.h.
bool RDKit::MolDrawOptions::continuousHighlight = true |
Definition at line 121 of file MolDraw2D.h.
bool RDKit::MolDrawOptions::dummiesAreAttachments = false |
Definition at line 118 of file MolDraw2D.h.
bool RDKit::MolDrawOptions::fillHighlights = true |
Definition at line 123 of file MolDraw2D.h.
double RDKit::MolDrawOptions::fixedBondLength |
Definition at line 172 of file MolDraw2D.h.
double RDKit::MolDrawOptions::fixedScale |
Definition at line 167 of file MolDraw2D.h.
int RDKit::MolDrawOptions::flagCloseContactsDist = 3 |
Definition at line 127 of file MolDraw2D.h.
int RDKit::MolDrawOptions::highlightBondWidthMultiplier = 8 |
Definition at line 157 of file MolDraw2D.h.
DrawColour RDKit::MolDrawOptions::highlightColour {1, 0.5, 0.5} |
Definition at line 120 of file MolDraw2D.h.
std::vector<DrawColour> RDKit::MolDrawOptions::highlightColourPalette |
Definition at line 161 of file MolDraw2D.h.
double RDKit::MolDrawOptions::highlightRadius = 0.3 |
Definition at line 125 of file MolDraw2D.h.
bool RDKit::MolDrawOptions::includeAtomTags |
Definition at line 129 of file MolDraw2D.h.
DrawColour RDKit::MolDrawOptions::legendColour |
Definition at line 142 of file MolDraw2D.h.
int RDKit::MolDrawOptions::legendFontSize = 12 |
Definition at line 136 of file MolDraw2D.h.
int RDKit::MolDrawOptions::maxFontSize = 40 |
Definition at line 138 of file MolDraw2D.h.
double RDKit::MolDrawOptions::multipleBondOffset = 0.15 |
Definition at line 144 of file MolDraw2D.h.
double RDKit::MolDrawOptions::padding |
Definition at line 146 of file MolDraw2D.h.
bool RDKit::MolDrawOptions::prepareMolsBeforeDrawing = true |
Definition at line 159 of file MolDraw2D.h.
double RDKit::MolDrawOptions::rotate = 0.0 |
Definition at line 180 of file MolDraw2D.h.
DrawColour RDKit::MolDrawOptions::symbolColour |
Definition at line 153 of file MolDraw2D.h.