Juha Siitonen (@juhesiit.bsky.social)
@juhesiit
Assistant professor of organic chemistry and academy research fellow @AaltoUniversity. Synthesis, theoretical chemistry, education and running.
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http://etosgroup.fi 08-06-2019 22:43:29
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I'm happy to announce that crestparse v. 0.2.2 has been released. New features include direct geometry parameter measurements and improvements to the export functions. Thanks to Cristina Trujillo 🖥️ ⚛️ for contributions! github.com/juhesiit/crest…