Python Draw.MolDraw2DFromQPainter_示例

示例#1

 def testfunc():
     m = Chem.MolFromSmiles('c1ccccc1O')
     Draw.PrepareMolForDrawing(m)
     qimg = QImage(250, 200, QImage.Format_RGB32)
     with QPainter(qimg) as qptr:
         p = sip.unwrapinstance(qptr)
         d2d = Draw.MolDraw2DFromQPainter_(250, 200, p, -1, -1)
     raise ValueError("expected")

示例#2

 def testSIPBasics(self):
     m = Chem.MolFromSmiles('c1ccccc1O')
     Draw.PrepareMolForDrawing(m)
     qimg = QImage(250, 200, QImage.Format_RGB32)
     with QPainter(qimg) as qptr:
         p = sip.unwrapinstance(qptr)
         d2d = Draw.MolDraw2DFromQPainter_(250, 200, p)
         d2d.DrawMolecule(m)
     qimg.save("testImageFromPyQt-1.png")