Really happy that our work on conditioning diffusion models is published - have a read if you fancy hearing how we tried to encourage the models to generate more physically plausible compounds by training conditionally with a synthetic, distorted molecules!
01.04.2025 10:52 — 👍 11 🔁 2 💬 0 📌 0
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Physicochemical deep learning, protein-ligand docking and scoring, computer-aided drug discovery and design, cheminformatics. All views my own. @morrislab@fediscience.org 🏳️🌈🇪🇺
