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📌About Us

We are a drug discovery team with an interest in the development of publicly available open-source customizable cheminformatics tools to be used in computer-assisted drug discovery. We belong to the Laboratory of Bioactive Compounds Research and Development (LIDeB) of the National University of La Plata (UNLP), Argentina. Our research group is focused on computer-guided drug repurposing and rational discovery of new drug candidates to treat epilepsy and neglected tropical diseases.

💻Web Site https://lideb.biol.unlp.edu.ar


SOMoC

SOMoC is a clustering methodology based on the combination of molecular fingerprinting, dimensionality reduction by the Uniform Manifold Approximation and Projection (UMAP) algorithm and clustering with the Gaussian Mixture Model (GMM) algorithm.

If you are looking to contact us, please send a mail to [email protected] or contact us by Twitter (https://twitter.com/LIDeB_UNLP)

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  • Python 100.0%