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Our (mini) review on deep learning for low-data drug discovery is now out! doi.org/10.1016/j.sbi.… There are honestly few things I enjoy as much as writing a review. It's so satisfying Especially together with Helena Brinkmann emanuele criscuolo Luke Rossen Rıza Özçelik Francesca Grisoni

Playing with #AI is nice, but applying it is the real deal! Within 3 cycles, we optimized nanoparticle uptake in cancer cells by almost 15 fold. Cool for drug delivery, but mostly a lot of fun🧪 Ana Ortiz Roy van der Meel Francesca Grisoni Lorenzo Albertazzi paper: doi.org/10.1039/D4DD00…

De novo drug design was getting stale until Rıza Özçelik came along with state space models to spice it up. Even though I'm totally biased, I think its really well done work :)

📢 JOB ALERT 📢 My team Molecular Machine Learning is searching for a #postdoc with a background in medicinal chemistry! 👩‍🔬👨‍🔬🧪 Do you have the experience? Are you eager to contribute to #AI for discovering new drugs? 👉Then DM me! Funded by European Research Council (ERC) and located at TU Eindhoven 🚀

A good read on the perceived success of molecular machine learning. Don't forget your statistical tests guys! nature.com/articles/s4225…

A must read if you're doing molecular machine learning chemrxiv.org/engage/chemrxi…

🚨Excited to share our new preprint: "Automated navigation of condensate phase behavior with active machine learning" doi.org/10.26434/chemr… Francesca Grisoni Molecular Machine Learning In collaboration with: Luc Brunsveld & Jan van Hest groups! #MachineLearning #PhaseSeparation #automation 👇

I want to delete my twitter account because of the Muskonian nature of this platform. What is the best alternative medium to stay in touch with the scientific community?

I have moved to bluer pastures. Follow me at BlueSky at derekvtilborg.bsky.social

We just preprinted a fresh study on molecular machine learning on OOD molecules 🧠 Using joint modeling, we could detect distribution shifts, estimate prediction reliability, and capture meaningful molecular patterns! doi.org/10.26434/chemr… #AI #chemistry Molecular Machine Learning