Install and Setup

Requirements

BeGin works with the following Python packages:

• pytorch == 1.8.1

• dgl >= 0.6.1

• ogb >= 1.3.4

• torch-scatter >= 2.0.6

• torch-sparse >= 0.6.9

• torch-geometric >= 2.0.4

• dgllife <= 0.3.0

• rdkit-pypi

For running some examples, you may need the following additional packages:

• quadprog

• cvxpy

• qpth

Installation

You can install BeGin with the following command:

pip install -e .