molecularxtal.bsky.social
Computational Chemist. 🦀🐍 Scientist at BAM + Professor FSU Jena. Only private opinions here. Last name: German pronunciation. 🏳️🌈 she/they (sie). @JaGeo on github
👤 Joined on 04 Ağustos 2023
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But hey, congratulations on the submission and the independent confirmation.
Show PostAh fair enough. Also the downside of open data when you want to publish from it...
Show PostThey had access to your data? Good to share tools, of course.
Show Post#compchem Good read: Physics-based molecular fingerprints from spectral graph theory provide efficient geometry-aware measures of chemical similarity. doi.org/10.1039/d6sc...
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