polymerist.rdutils
==================

.. py:module:: polymerist.rdutils

.. autoapi-nested-parse::

   Utilities for generating, labelling, editing, and transforming RDKit molecules and other RDKit objects



Submodules
----------

.. toctree::
   :maxdepth: 1

   /autoapi/polymerist/rdutils/bonding/index
   /autoapi/polymerist/rdutils/chemlabel/index
   /autoapi/polymerist/rdutils/rdcoords/index
   /autoapi/polymerist/rdutils/rdgraphs/index
   /autoapi/polymerist/rdutils/rdkdraw/index
   /autoapi/polymerist/rdutils/rdprops/index
   /autoapi/polymerist/rdutils/reactions/index
   /autoapi/polymerist/rdutils/sanitization/index
   /autoapi/polymerist/rdutils/selection/index
   /autoapi/polymerist/rdutils/substructures/index


Functions
---------

.. autoapisummary::

   polymerist.rdutils.set_rdkdraw_size
   polymerist.rdutils.enable_substruct_highlights
   polymerist.rdutils.disable_substruct_highlights
   polymerist.rdutils.enable_kekulized_drawing
   polymerist.rdutils.disable_kekulized_drawing


Package Contents
----------------

.. py:function:: set_rdkdraw_size(dim: int = 300, aspect: float = 3 / 2)

   Change image size and shape of RDKit Mol images


.. py:function:: enable_substruct_highlights() -> None

   Turns on highlighting of found substructures when performing substructure matches


.. py:function:: disable_substruct_highlights() -> None

   Turns off highlighting of found substructures when performing substructure matches


.. py:function:: enable_kekulized_drawing() -> None

   Turns on automatic kekulization of aromatic bonds before drawing molecules in Jupyter Notebooks


.. py:function:: disable_kekulized_drawing() -> None

   Turns off automatic kekulization of aromatic bonds before drawing molecules in Jupyter Notebooks