Is Open Babel development over? Last release was May 2020, last commit to master 2 years ago. Or am I missing something?
11.03.2026 20:53
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Is Open Babel development over? Last release was May 2020, last commit to master 2 years ago. Or am I missing something?
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Many of my university exams allowed this. By the time the sheet was ready, I was well prepared for the exam. It was so packed and written so tiny that it was useless if I didn’t already know the content. 😅
Have you always wanted to use CP2K but found the online manual too superficial and our JCP 2020 code review paper (doi.org/10.1063/5.00...) too theoretical? Then our new overview paper "The CP2K Program Package Made Simple" from the user's perspective is just right for you!
doi.org/10.1021/acs....
👉 Students, have a look at the available internship positions and apply! It could be the first step toward an inspiring career in computational science: jobs.ethz.ch/job/view/JOP... #internship #students #hpc
The paper, discussing the integration of asynchronous MPI messaging with tasking runtimes using C++26 std::execution, is already available open access.
Check it out!
doi.org/10.1145/3731...
Congrats @dheerajprakaash.bsky.social! Best of luck for the new adventure!
Team building in Switzerland be like:
If you are using or you are considering using CP2K, check this out!
A milestone for open AI: ETH Zurich and EPFL will release a fully open multilingual language model, trained on CSCS’s “Alps” supercomputer. Built for the public good, this model promotes transparency, inclusion, and innovation.
Read more:
#CSCS is pleased to announce the workshop "Hands-on Introduction to Deep Learning with PyTorch", which will be held from Wednesday, July 2 to Friday, July 4, 2025, at CSCS in Lugano, Switzerland. Register now: www.cscs.ch/publications...
📢 We’re live! Our Digital Annual Report is now online. 🎉 Discover the past year's highlights, key achievements, and milestones in an interactive and accessible format. 👉 Explore the report here: report2024.cscs.ch #report #wearealps #digitalannualreport #cscs
Protein laparoscopy!
Yes, it’s radish on top of trout belly from the local river. It was really delicate and tasty.
Today I had a truly special experience at Clos Vauban (Langres, France). They recently won a Michelin star, and the food was delicious. 💫 But seeing my brother working in the kitchen was even better than the amazing food. 🤩
MDAnalysis 2.9.0 (and its blog post) is out: www.mdanalysis.org/2025/03/11/r...!
Includes:
* Additional Gromacs/distopia/parallel analysis support
* New "water"/"precision" keywords
🙏 to the release's 10 contributors (3 new), and to @numfocus.bsky.social/@chanzuckerberg.bsky.social for support.
Check this out!
GNINA 1.3 comes with a PyTorch backend, improved models, and functionality for covalent docking.
doi.org/10.1186/s133...
End of an era. I used Piz Daint for the first time during my MSc in Physics at EPFL in 2015-2016 to study oxygen defects in InAlN semiconductors with QuantumESPRESSO. So sad I had to miss the shutdown ceremony. 🤒
Congratulations Irfan, well deserved!
Just arrived in Grindelwald (CH) for the @snsf-ch.bsky.social #NCCR #MARVEL Retreat & Review 2025. Looking forward to three days of interesting talks and discussions.
We're here! 🎉 CSCS has joined Blue Sky! Follow us for updates on cutting-edge supercomputing, science breakthroughs, and the tech-driving innovation. 🚀 #supercomputing #CSCS #myCSCS #wearealps
Ah! Good to know it might be a “me” problem. When I press Play on iOS, it looks like the stream is about to start, but then it stops immediately. It’s been happening since episode 1. I just tested on macOS, and there it works. I had no issues with other podcasts.
Nice! FYI, for some unknown reason I can’t listen on Apple’s Podcasts app.
We released MDAnalysis 2.8.0 🚀 See the blog post www.mdanalysis.org/2024/11/22/r... . Highlights: (1) all code under the GNU Lesser General Public License, (2) new Guesser API, (3) general parallelization for analysis tools, (3) DSSP analysis class, (4) more MDAKits.
