scikit-learn is a Python module for machine learning built on top of SciPy and is distributed under the 3-Clause BSD license. The project was started in 2007 by David Cournapeau as a Google Summer of ...
In computational chemistry, molecules are often represented as molecular graphs, which must be converted into multidimensional vectors for processing, particularly in machine learning applications.
Code samples for the machine learning algorithms that are explained in the book, "Hands-on Machine Learning with Scikit-Learn and Tensorflow: Concepts, Tools, and Techniques to Build Intelligent ...