The Ersilia Model Hub
A free, open-source repository of pre-trained AI/ML models for drug discovery and global health.
Fetch, serve, and run AI tools for antibiotic drug discovery and beyond.
The Ersilia Model Hub is a recognised Digital Public Good (DPG) by the DPG Alliance. It is a continuously expanding, fully maintained collection of AI/ML models for drug discovery, designed to drive adoption and practical use in wet-lab settings.
Browse our catalog of models related to small-molecule property and activity prediction, molecular representation, and sampling.
Learn how to get started with Ersilia using a simple command-line interface to manage and run models on your system.
We are an open source community bringing together chemists, biologists, developers, and data scientists.
Commits in GitHub
The Ersilia ecosystem is the result of contributions from an active and diverse community.
Unique contributors
We bring together senior and junior data scientists and software engineers.
Models for drug discovery
Each model in the Ersilia Model Hub has its own repository with code, parameters, dependencies, and metadata.
Organization's repositories
We develop tools and carry out analyses tailored to specific projects. All of them are accessible in open source repositories.
Scientific publications
Our work is publication-driven. We publish computational research in peer-reviewed journals.
Pathogens of interest
Our tools focus on WHO-designated priority pathogens and the causative agents of neglected tropical diseases.
Built with the Ersilia Model Hub