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<!DOCTYPE html>
<html lang="en">
<head>
<meta charset="utf-8">
<meta name="viewport" content="width=device-width, initial-scale=1.0">
<title>Antonio de la Vega de León — AI/ML for Drug Discovery</title>
<meta name="description" content="Machine learning and chemoinformatics consulting for drug discovery. QSAR modelling, ML interpretation, and AI for novel drug targets.">
<link href="https://fediscience.org/@adlvdl" rel="me">
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<body>
<nav class="site-nav" id="site-nav">
<a class="nav-logo" href="index.html">delavega.ai</a>
<ul class="nav-links">
<li><a href="index.html" class="nav-active">Home</a></li>
<li><a href="services.html">Services</a></li>
<li><a href="blog.html">Blog</a></li>
<li><a href="publications.html">Publications</a></li>
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<section class="hero">
<div class="container">
<div class="hero-inner">
<div class="hero-left">
<span class="mono-tag anim-1">ml-consulting / chemoinformatics</span>
<span class="hero-name anim-2">Antonio de la Vega de León</span>
<h1 class="anim-3">AI/ML for<br><em>Drug Discovery</em></h1>
<p class="hero-body anim-4">
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.
</p>
<div class="hero-actions anim-5">
<a href="https://calendar.proton.me/bookings#srNPliRTvP3FDewAuttYXfh4r6iIdNgXm46-TZyGOKA=" class="btn-primary" target="_blank" rel="noopener">Book a call →</a>
<a href="services.html" class="btn-secondary">View services →</a>
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<div class="hero-stats">
<div class="stat-item">
<div class="stat-value">26+</div>
<div class="stat-label">peer-reviewed publications</div>
</div>
<div class="stat-item">
<div class="stat-value">10+</div>
<div class="stat-label">years of research experience</div>
</div>
<div class="stat-item">
<div class="stat-value">4+</div>
<div class="stat-label">years of industry experience</div>
</div>
<div class="stat-item">
<div class="stat-value">PhD</div>
<div class="stat-label">ML & chemoinformatics</div>
</div>
</div>
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</div>
</section>
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<a class="section-card" href="services.html">
<span class="mono-tag">services</span>
<h3>Consulting</h3>
<p>Design and implementation of ML workflows for drug discovery as well as teaching ML and chemoinformatics.</p>
<span class="card-link">View services ›</span>
</a>
<a class="section-card" href="blog.html">
<span class="mono-tag">writing</span>
<h3>Blog</h3>
<p>Technical posts on machine learning methods, cheminformatics experiments, and applied data science for drug discovery.</p>
<span class="card-link">Read the blog ›</span>
</a>
<a class="section-card" href="about.html">
<span class="mono-tag">background</span>
<h3>About</h3>
<p>Learn more about my career and research interests.</p>
<span class="card-link">About me ›</span>
</a>
</div>
</div>
<div class="container">
<div class="post-strip">
<span class="post-strip-label">latest post</span>
<div class="post-strip-content">
<a class="post-strip-title" href="posts/2026_04_22_ml_baseline.html">PXR Challenge #2: Training and Comparing ML Baseline Models</a>
<span class="post-strip-meta">2026-04-22 · blind challenge</span>
</div>
<a class="post-strip-link" href="posts/2026_04_22_ml_baseline.html">Read post ›</a>
</div>
</div>
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<span class="footer-logo">delavega.ai · 2026</span>
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<li><a href="https://www.linkedin.com/in/adlvdl/" target="_blank" rel="noopener">LinkedIn</a></li>
<li><a href="https://orcid.org/0000-0003-0927-2099" target="_blank" rel="noopener">ORCID</a></li>
<li><a href="https://www.researchgate.net/profile/Antonio_De_La_Vega_De_Leon" target="_blank" rel="noopener">ResearchGate</a></li>
</ul>
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