News SIMPLAIX
On Machine Learning and disordered materials: Volker Deringer at the HITS-SIMPLAIX Colloquium
On 23 October 2023, Volker Deringer from University of Oxford gave a joint HITS-SIMPLAIX Colloquium on machine-learning-driven advances in modeling and understanding disordered …
New SIMPLAIX PI: Jan Stühmer
Computer scientist Jan Stühmer, group leader at HITS and Junior professor at the Karlsruhe Institute of Technology (KIT), has been …
Registration now open: 2nd SIMPLAIX Workshop on “Machine Learning for Multiscale Molecular Modeling”
The 2nd SIMPLAIX Workshop on “Machine Learning for Multiscale Molecular Modeling” will take place in the Studio Villa Bosch in Heidelberg …
On Chemistry and Machine Learning: Fernanda Duarte at the HITS-SIMPLAIX Colloquium
On 28 September 2023, Fernanda Duarte from University of Oxford gave a joint HITS-SIMPLAIX Colloquium on exploring chemical reactivity in the age of …
New SIMPLAIX PI: Tristan Bereau
Computational physicist Tristan Bereau, professor at the Institute for Theoretical Physics, Heidelberg University, has been appointed new Principal Investigator in the …
Anya’s author profile in Helvetica Chimica Acta
Read Anya’s thoughts on the challenges and future of computational chemistry, find out why she became a computational chemist, and …
SIMPLAIX Workshop: Thanks to all participants!
A big thank you to all the speakers and participants for making last week’s SIMPLAIX Workshop on “Machine Learning for …
Registration now open: SIMPLAIX Workshop on “Machine Learning for Multiscale Molecular Modeling”
The first SIMPLAIX Workshop on “Machine Learning for Multiscale Molecular Modeling” will take place in the Studio Villa Bosch in Heidelberg …
Neural networks and computational chemistry
On 26 September 2022, Olexandr Isayev (Carnegie Mellon University, USA) visited HITS and SIMPLAIX and gave a joint HITS/SIMPLAIX (hybrid) talk on “…
SIMPLAIX No 5 – a certain scent of magic
On 15 September afternoon, the 5th SIMPLAIX internal meeting took place at the Studio Villa Bosch in Heidelberg. More than 20 members of …
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