"Making expert work cheaper does not simply replace experts. It creates more situations where expert judgment is needed."
every.to/p/after-auto...
#compchem
Due to a last minute cancellation, we will start at 10:30 on Monday
#compchem
New preprint: Practical computational exploration of chemical reaction space: Assessing the chemical stability of active pharmaceutical ingredients under acidic conditions
doi.org/10.26434/che... #compchem
I stopped reading it after "Sure! Here's a Papal Encyclical on AI ..."
New highlight: Harnessing AtomisticSkills for Agentic Atomistic Research www.compchemhighlights.org/2026/05/harn... #compchem
It's already Day 4! The penultimate day of the CPH 🇩🇰 #summerschool has kicked off with a lecture from @jonasverhellen.bsky.social, who is sharing his thoughts on #computational diversity in the age of #XAI. Follow the rest of the talks (no signup required) ---> aichemist.eu/lectures.
📢 Join us online at the AiChemist CPH Summer School (15–19 June 2026)!
Explore #ExplainableAI in #Chemistry & #Toxicology with top speakers from academia, industry & regulators.
🔗 Full (hybrid) Programme: aichemist.eu/lectures
#XAI #MachineLearning #Cheminformatics #AI4Science
Jan H. Jensen
Jan H. Jensen
Jan H. Jensen
Jan H. Jensen
Jan H. Jensen
Jan H. Jensen
Jan H. Jensen
AiChemist MSCA DN
AiChemist MSCA DN
Bowen Deng, Bohan Li, Matthew Cox, Hoje Chun, Juno Nam, Artur Lyssenko, Sathya Edamadaka, Jurgis Ruza, Xiaochen Du, Nofit Segal, Jesus Diaz ...
I am organising a 2 day workshop on explainable AI as applied to (bio)chemistry in Copenhagen, June 15-16, 2026.
Everyone is invited. No need to register, but lunch is at your own expense.
#compchem
Spent a plane ride reading Pope Leo's Encyclical on AI. Many thoughts to share later, but this will stick with me: "The quality of a civilization is measured not by the power of its means, but by the care it is able to offer, by its ability to recognize the other as a face not merely as a function."
T-REX is roaming #RSCDigital! 🦖
Kevlishvili and Dorabawila introduce a canonical, geometry-aware language for transition-metal complexes, opening new paths for generative design and machine learning in inorganic chemistry.
👉Read it now: doi.org/10.1039/D6DD...
#GenerativeDesign #TMcomplexes
Try out the interactive UMA playground from Meta. It's a lot of fun. 😀 aidemos.atmeta.com/uma
