2D depiction of molecules using OBPainter.
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#include <openbabel/depict/depict.h>
List of all members.
Public Types |
| enum | AtomLabelType {
AtomId = 1,
AtomIndex,
AtomSymmetryClass,
AtomValence,
AtomTetrahedralStereo
} |
| enum | OptionType {
bwAtoms = 0x0001,
internalColor = 0x0002,
drawTermC = 0x0010,
drawAllC = 0x0020,
noWedgeHashGen = 0x0100,
asymmetricDoubleBond = 0x0200
} |
Public Member Functions |
| | OBDepict (OBPainter *painter) |
| | ~OBDepict () |
| bool | DrawMolecule (OBMol *mol) |
| bool | AddAtomLabels (AtomLabelType type) |
| void | SetBondLength (double length) |
| double | GetBondLength () const |
| void | SetPenWidth (double length) |
| double | GetPenWidth () const |
| void | SetBondSpacing (double spacing) |
| double | GetBondSpacing () const |
| void | SetBondWidth (double width) |
| double | GetBondWidth () const |
| void | SetOption (unsigned opts) |
| unsigned | GetOptions () const |
| void | ClearOptions () |
| void | SetFontFamily (const std::string &family) |
| const std::string & | GetFontFamily () const |
| void | SetFontSize (int pointSize, bool subscript=false) |
| int | GetFontSize (bool subscript=false) const |
| void | SetAliasMode (bool b=true) |
| void | SetBondColor (const std::string &scolor) |
Detailed Description
2D depiction of molecules using OBPainter.
- Since:
- version 2.3
Member Enumeration Documentation
- Enumerator:
| AtomId |
|
| AtomIndex |
|
| AtomSymmetryClass |
|
| AtomValence |
|
| AtomTetrahedralStereo |
|
- Enumerator:
| bwAtoms |
|
| internalColor |
|
| drawTermC |
|
| drawAllC |
|
| noWedgeHashGen |
|
| asymmetricDoubleBond |
|
Constructor & Destructor Documentation
Member Function Documentation
| bool DrawMolecule |
( |
OBMol * |
mol |
) |
|
Draw mol using the painter previously stored in the constructor.
- Returns:
- True if successful.
d->drawTerminalC)
Draw atom labels of a specified type.
- Returns:
- True if successful.
| void SetBondLength |
( |
double |
length |
) |
|
| double GetBondLength |
( |
|
) |
const |
| void SetPenWidth |
( |
double |
length |
) |
|
| double GetPenWidth |
( |
|
) |
const |
| void SetBondSpacing |
( |
double |
spacing |
) |
|
| double GetBondSpacing |
( |
|
) |
const |
| void SetBondWidth |
( |
double |
width |
) |
|
| double GetBondWidth |
( |
|
) |
const |
| void SetOption |
( |
unsigned |
opts |
) |
|
| unsigned GetOptions |
( |
|
) |
const |
| void SetFontFamily |
( |
const std::string & |
family |
) |
|
| const std::string & GetFontFamily |
( |
|
) |
const |
| void SetFontSize |
( |
int |
pointSize, |
|
|
bool |
subscript = false | |
|
) |
| | |
| int GetFontSize |
( |
bool |
subscript = false |
) |
const |
| void SetAliasMode |
( |
bool |
b = true |
) |
|
| void SetBondColor |
( |
const std::string & |
scolor |
) |
|
The documentation for this class was generated from the following files:
