NSF Center for Computer Assisted Synthesis (C-CAS)
Using quantitative, data-driven approaches to make synthetic chemistry more predictable. Phase II CCI #NSFFunded
🌐 ccas.nd.edu
📷 instagram.com/nsf_ccas/
- Applications to the C-CAS SURF program close TONIGHT at 11:59 PM PST. For more information, see our website ccas.nd.edu/outreach/sur... #summerresearch #REU #undergraduateresearch #chemistry #computerscience #science #stem #chemsky
- Deadline to apply is THIS FRIDAY (Jan 30) More info here: ccas.nd.edu/outreach/sur... #chemistry #computerscience #chemsky #summerresearch #REU #undergraduateresearch
- C-CAS is now accepting applications for the 2026 Summer Undergraduate Research Fellowship (SURF) Program. More details here: ccas.nd.edu/outreach/sur... #chemistry #computerscience #chemsky #summerresearch #REU #undergraduateresearch
- Check out this article featuring C-CAS member Sarah Reisman! www.chemistryworld.com/features/the... #chemsky #chemistry #AI #synthesis #datachemistry #machinelearning
- C-CAS has 100 publications 🎉🎉🎉🎉🎉 www.nature.com/articles/s42...
- 🚨C-CAS in the news🚨 Check out this op-ed written by C-CAS trainee Ernest Bennin! www.knoxnews.com/story/opinio...
- C-CAS members had a blast at @pacifichem.bsky.social 🌊 Especially great to see our Data Chemist Network members getting together to talk science 🧪 #chemsky #pacifichem #pacificchem2025 #chemistry
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- Ask C-CAS: What is synthetic chemistry? Dr. Emily Wearing, postdoctoral researcher at UCLA, breaks down the answer. Read the full answer on our website: ccas.nd.edu/outreach/ask... #chemsky #chemistry #computerscience #syntheticchemistry #datachemistry #ccas #nsf
- Meet Flora Fan, a PhD student in the lab of Dr. Abby Doyle at UCLA! Have a question for Flora? Let us know! #nsf #chemistry #ccas #meetascientist #computerscience #science #phd #stem #chemsky
- Congratulations to Dr. Dalia R. Biswas on being named as a Paul Garrett Fellow by @whitmancollege.bsky.social! www.whitman.edu/whitman-stor... #chemistry #computerscience #chemsky #nsf #datachemistry #ccas
- C-CAS is now accepting applications for the 2026 Summer Undergraduate Research Fellowship (SURF) Program. More details here: ccas.nd.edu/outreach/sur... #chemistry #computerscience #chemsky #summerresearch #REU #undergraduateresearch
- 📰C-CAS in the News 📰 DCN Members Dalia Biswas and Raychelle Burks were featured in an article about the new Whitman DIVAS program www.whitman.edu/whitman-stor... @whitmancollege.bsky.social @drrubidium.bsky.social #chemsky #chemistry #computerscience #compchem
- 📰C-CAS in the News 📰 This article highlights the work of C-CAS PIs @olexandr.bsky.social and @gabegomes.bsky.social as well as trainees Robert MacKnight, Nick Gao, and Liliana Gallegos. www.cmu.edu/mcs/news-eve... #chemistry #computerscience #nsf #chemsky
- 🚨 Opportunity Alert 🚨 Calling all Data Chemists! Apply for up to $5000 for the @acs.org Data Science and Modeling for Green Chemistry Award. See the link below for more details! www.acs.org/funding/awar...
- 🚨New Paper Alert 🚨 pubs.acs.org/doi/10.1021/... Congratulations to authors Nicholas Casetti, Dylan Anstine, @olexandr.bsky.social , and Connor Coley! #ccas #nsf #chemistry #computerscience #chemsky #datachemistry
- 🚨 Job Alert 🚨 Postdoctoral Researcher — IBM ibmglobal.avature.net/en_US/career... #NSF #C-CAS #chemistry #chemsky #datachemistry #computerscience
- Meet Jose Regio, a PhD student in the lab of @gabegomes.bsky.social at @cmuchemistry.bsky.social. Have a question for Jose? Let us know in the replies. #nsf #chemistry #ccas #meetascientist #computerscience #science #phd #stem #chemsky 1m
- Join us for the final week of the C-CAS Semiannual Meeting Series! RSVP here: forms.gle/hMkUk69TQ3Ri... (If you already RSVPed and have received the zoom link for previous meetings, you do not need to register again) #NSF #C-CAS #chemistry #chemsky #datachemistry #computerscience
- What’s new at NSF CMCC this September? 📑 A new publication in 𝐶ℎ𝑒𝑚𝑖𝑐𝑎𝑙 𝑆𝑐𝑖𝑒𝑛𝑐𝑒 (The Royal Society of Chemistry) 🎉 Dr. Speight co-organized the 2025 ACS Symposium 𝐵𝑙𝑎𝑐𝑘 𝐶ℎ𝑒𝑚𝑖𝑠𝑡𝑠 𝐵𝑟𝑒𝑎𝑘𝑖𝑛𝑔 𝑆𝑐𝑖𝑒𝑛𝑡𝑖𝑓𝑖𝑐 𝐵𝑎𝑟𝑟𝑖𝑒𝑟𝑠 … and more! Catch up on the latest CMCC highlights below 👇 #Mechanochemistry
- Join us for Week 4 of the C-CAS Semiannual Meeting Series! RSVP here: forms.gle/Nb3EucY2sJyx... (If you already RSVPed and have received the zoom link for previous meetings, you do not need to register again) #NSF #C-CAS #chemistry #chemsky #datachemistry #computerscience
- This past week, C-CAS PIs Olaf Wiest and Xiangliang Zhang, along with fellow faculty member Brett Savoie, hosted a Data Chemistry Bootcamp at the University of Notre Dame. Thank you to all of the participants and speakers! #ccas #chemistry #chemsky #computerscience #datachemistry #nsf #nsfcci
- Join us for Week 3 of the C-CAS Semiannual Meeting Series! Register here: forms.gle/L545Jc8Kj7jC... Note: if you already registered for Week 1 - 2, you do not need to register again. #NSF #C-CAS #chemistry #chemsky #datachemistry #computerscience
- Thank you to everyone who joined us on Monday! We're excited to share the lineup for week 2. Link to register: forms.gle/SdMQz7Ure3k5... #NSF #C-CAS #chemistry #chemsky #datachemistry #computerscience
- ✨ New paper in Nature Chemistry: Chemical and ribosomal synthesis of atropisomeric and macrocyclic peptides with embedded quinolines www.nature.com/articles/s41... Congrats to Isaac, Taylor, Diondra, Cameron, Tamir, Alanna, Scott, and collaborators! #NSFfunded
- The Week 1 Lineup is here! Register now to attend the C-CAS semiannual meeting series to check out these fantastic talks (and so many more)! Link to register: forms.gle/cfBFmf7h2Cs1... #NSF #C-CAS #chemistry #chemsky #datachemistry #computerscience
- Congratulations to Luca McDermott Catena (postdoctoral researcher in the @sarponggroup.bsky.social) and Omar Santiago Reyes (graduate student in the Reisman lab) on being named C-CAS DARE Fellows for 2025-2026! ccas.nd.edu/news-events/...
- Classroom packed — the Givadan-Karrer Lectures by Sarah Reisman have begun! If you missed the first class, you can still join us on Fri 3.9., Mon 8.9. or Tue 9.9. for the next three classes, or on Wed 10.9. for the award lecture. Come experience organic synthesis at its finest! @chem.uzh.ch
- The 10th Semi-Annual C-CAS meeting series is fast approaching. Come join us to learn about the exciting work being done at C-CAS and from our industrial partner! See the registration form for more details: forms.gle/yv6F4E2s4H8J... #chemsky #nsf #ccas #datachemistry #computerscience
- What’s new at the NSF CMCC this August? 📑 Two new publications in the Journal of the American Chemical Society 🎉 Rodney Amankwah, from the Speight group at William & Mary, received a NOBCChE travel award … and much more! Catch up on the latest CMCC highlights below. 👇 #Mechanochemistry #STEM
- In our inaugural #askccas video, postdoctoral fellow Emily Wearing interviews PhD student Blake Day about why chemistry is important to him. Have a question for C-CAS? Let us know! #nsf #chemistry #computerscience #ccas #interview #chemsky
- Niko did an amazing job this summer! So glad to host his visit
- Molecular structures made from crocheting yarn were on display at the Chemistry Crochet Social Hour sponsored by the @nsf-csoe.bsky.social, where attendees had a chance to make their own creations. cen.acs.org/acs-news/acs... #ACSFall2025 #chemsky
- Congratulations to Qintao Jia in the Toledo lab for being awarded the Inorganic Chemistry Sponsored Prize for his poster presentation at #ACSFall2025 #ccas #nsf #chemistry #computerscience #chemsky #ACS
- Congrats @dmeremin.bsky.social!
- Had a pleasure introducing REyes, a fully autonomous, open-source electron diffraction suite at #ACSFall2025. Many thanks to the organizers @olexandr.bsky.social and #CASFutureLeaders for the opportunity #ReciprocalEyes #chrmsky @caltechcce.bsky.social @hoseanelson.bsky.social @nsf-ccas.bsky.social
