Graphein is a Python package designed to produce geometric representations of protein and RNA structures, and biological interaction networks. It offers compatibility with popular deep learning libraries and formats, facilitating the construction and analysis of graphs related to computational biology. Graphein supports the creation of various types of graphs including protein graphs, molecular graphs, RNA graphs, and interaction networks, utilizing data from extensive bioinformatics databases. The library provides both a programmatic API and command-line interface, making it flexible for diverse applications in machine learning and biochemical analysis.
• compatible with geometric deep learning libraries
• early-stage project with ongoing improvements
• data retrieval from bioinformatics databases
• command-line interface and api
• constructs protein, rna, and interaction graphs
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