Very humbled to see our research with @jakubmartinka.bsky.social, Lina, Mikolaj, Yi-Fan, Jiri, and @mbarbatti.bsky.social among the most-read recent articles in J Phys Chem Lett. Paper: doi.org/10.1021/acs.... My personal account of the study’s background: dr-dral.com/jpcl-a-descr...

A Descriptor Is All You Need: Accurate Machine Learning of Nonadiabatic Coupling Vectors #CompChem at J Phys Chem Letters doi.org/10.1021/acs....

It was a great pleasure to visit the beautiful city of Toruń for the Molecular Excited States workshop. There were many interesting talks and 𝗲𝘅𝗰𝗶𝘁𝗶𝗻𝗴 discussions. A big thanks to the organisers! #MolEx2025

A simple approach to rotationally invariant #machine_learning of a vector quantity in #compchem 🧪 doi.org/10.1063/5.02...