ml-consulting / chemoinformatics Antonio de la Vega de León

AI/ML for
Drug Discovery

I help pharmaceutical and biotech teams design machine learning-based workflows to enhance decision making in drug discovery, leading to faster and more efficient discovery projects.

26+
peer-reviewed publications
10+
years of research experience
4+
years of industry experience
PhD
ML & chemoinformatics
worked with
services

Consulting

Design and implementation of ML workflows for drug discovery as well as teaching ML and chemoinformatics.

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writing

Blog

Technical posts on machine learning methods, cheminformatics experiments, and applied data science for drug discovery.

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background

About

Learn more about my career and research interests.

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latest post
PXR Challenge #4: Almost at the end of phase 1 2026-05-21 · blind challenge
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