Adam Pecina
adampecina.bsky.social
Computational Chemist | Researcher at IOCB Prague 🇨🇿 I specialize in quantum chemistry and computational drug design. Alumnus of Charles University & Palacký University. Former postdoc at the Italian Institute of Technology & Marie Curie (IF) Fellow.
👤 Joined on 10 March 2025
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- 10 Mar 2025, 10:11
🎉 Bluesky'e katıldı - İlk kullanıcı adı:
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I don't have any more detailed information. The story I linked to links to the data coming from the Ministry of Higher Education and Science but doesn't give details. There's a comment from a TT unit saying that it doesn't include derived effects to the society and companies
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Day 1 of the winter semester. Good luck to all of us @vschtpraha.bsky.social.
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🚀 Benchmark paper out! How well do DFT, semiempirical & ML methods model proton transfer? ✅ DFT performs well, except with N-groups ❌ Pure ML struggles (though ORB v3 shows big gains) 🔥 PM6-ML Δ-learning excels, even in QM/MM setups! Check it out: pubs.acs.org/doi/10.1021/...
Show PostDenmark — Northern Ireland Let’s go
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