schrodinger.application.pathfinder.render module¶
Functions and classes for rendering a Route as an image.
- class schrodinger.application.pathfinder.render.RouteRenderer(plus_size=50, arrow_length=250, arrowhead_size=25, label_padding=25, label_font=('helvetica', 30), plus_font=('helvetica', 48), max_scale=0.3, mol_padding=50, scale=0.375, logger=None)¶
Bases:
objectA class for rendering a Route as an image.
Note: this class only supports “specific routes”, for which all nodes have a ‘mol’ attribute. Generic routes, in which nodes might have only a reagent class, are not supported yet.
- __init__(plus_size=50, arrow_length=250, arrowhead_size=25, label_padding=25, label_font=('helvetica', 30), plus_font=('helvetica', 48), max_scale=0.3, mol_padding=50, scale=0.375, logger=None)¶
Configure the RouteRenderer with various optional parameters controlling the layout of the route. All sizes are in pixels.
- Parameters
plus_size – width (including padding) taken by the plus signs.
- renderToFile(route, filename)¶
Render a Route and save the image to a file.
- schrodinger.application.pathfinder.render.mol_to_qpicture(mol)¶
Generate a QPicture from an RDKit Mol.
- Parameters
mol – molecule to render
- Return type
QPicture