Steven Kearnes @StevenKearnes
Machine learning for drug design Joined March 2013-
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@vijaypande Maybe this is what happened to Egyptian? (Why are there no hieroglyph emojis??)
@curiouswavefn Found this when searching for the text: pubmed.ncbi.nlm.nih.gov/23318152/#:~:t…
@Support X says it can't find my @OpenReactionDB account? Perhaps it was deleted due to inactivity? I'd like to reactivate it please.
New tutorial alert: Watch @cwcoley from MIT and @StevenKearnes from @Relay_Tx discuss the structure and applications of the Open Reaction Database! Link: youtu.be/eMbgkvNek0c #OpenReactionDatabase #Chemistry #innovation #ComputationChemistry #NSF #CCAS
Excited to have @ben_deadman on board!
Happy to announce that I have joined the Open Reaction Database as their new data evangelist and program manager. Looking forward to supporting the ORD through an exciting phase of development and expansion. Follow us on LinkedIn to get the latest news. linkedin.com/feed/update/ur…
Congrats to the Open Reaction Database team for their work to create open data for chemistry, supported by @SchmidtFutures. #AIforScience
We are happy to announce that the Open Reaction Database (ORD) has been awarded a grant as recommended by @SchmidtFutures, a philanthropic initiative founded by Eric and Wendy Schmidt. This grant will support the next phase of growth and adoption for the ORD, including:
See our recent perspective advocating for stronger data sharing requirements: pubs.acs.org/doi/10.1021/ac… See our original announcement of the ORD in JACS: pubs.acs.org/doi/10.1021/ja…
We are grateful to the research community for helping the ORD reach this important milestone through your contributions, suggestions, and use of the database. We have big plans for the future, so stay tuned! Website: open-reaction-database.org
We are happy to announce that the Open Reaction Database (ORD) has been awarded a grant as recommended by @SchmidtFutures, a philanthropic initiative founded by Eric and Wendy Schmidt. This grant will support the next phase of growth and adoption for the ORD, including:
Our (biased) perspective on data sharing in chemistry: pubs.acs.org/doi/10.1021/ac…
@davidlmobley I'll bet linkedin.com/in/ianwetherbee would know
@eigendecay @wpwalters @drGregBowman That's my day job 🙂. In the long run, driving down cycle times is going to be more impactful than being smarter with small, high-latency data. Both are good pursuits in the short/medium term.
2/ I'll briefly describe the Open Reaction Database (pubs.acs.org/doi/10.1021/ja…) in Monday PM's "Data formats, Open Databases, APIs & Data Accessibility" session on behalf of the team including @StevenKearnes and others
Read more about Automated Chemical Design: pubs.acs.org/doi/10.1021/ac…
Here at Relay Tx, we are harnessing the power of both humans and machines towards the goal of creating novel medicines. Together, there is an unstoppable partnership. Tony Stark is more effective in his Iron Man suit, right? 🥼🤖
It's official: `pip install rdkit` 🎉 github.com/rdkit/rdkit/pu…
How automated is your chemical design platform? Introducing Automated Chemical Design (ACD) Levels to help researchers place their work in the context of system-level optimization. pubs.acs.org/doi/10.1021/ac…
Announcing CACHE, a prospective computational hit finding competition. Select 100 compounds for the first target, LRRK2: CACHE will order and test them experimentally. All data will be public. Apply by Jan. 31st. bit.ly/3EiIVJC bit.ly/3obhyvm @thesgconline
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