  Covalent Organic Frameworks (COFs) have gained significant popularity in
recent years due to their unique ability to provide a high surface area and
customizable pore geometry and chemistry. These traits make COFs a highly
promising choice for a range of applications. However, with their vast
potential structures, exploring COFs experimentally can be challenging and
time-consuming, yet it remains an attractive avenue for computational
high-throughput studies. However, generating COF structures can be a
time-consuming and challenging task. To address this challenge, here we
introduce the pyCOFBuilder, an open-source Python package designed to
facilitate the generation of COF structures for computational studies. The
pyCOFBuilder software provides an easy-to-use set of functionalities to
generate COF structures following the reticular approach. In this paper, we
describe the implementation, main features, and capabilities of the
pyCOFBuilder demonstrating its utility for generating COF structures with
varying topologies and chemical properties. pyCOFBuilder is freely available on
GitHub at https://github.com/lipelopesoliveira/pyCOFBuilder.
