Ashley Ringer McDonald
@aringermcdonald.bsky.social
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📥 98
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Computational chemist, Professor, Cal Poly SLO. MolSSI Board of Directors. Past Chair ACS COMP.
Happy Pi Day, everyone! I hope the pie police don’t come for me for calling these mini French fruit tarts pies.
3 days ago
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Ashley Ringer McDonald
MDAnalysis
22 days ago
MDAnalysis is participating in
#GSoC
2026! 👉 Read our blog post for details on how you can apply to work with MDAnalysis through GSoC:
www.mdanalysis.org/2026/02/19/g...
🗓️ Pre-proposals must be submitted by March 9. ❗For transparency and fairness, use public forums for all
#GSoC
communications.
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Ashley Ringer McDonald
Geoff Hutchison
23 days ago
Has
@avogadro.cc
helped your research? Teaching? As we prepare Avogadro 2.0 for release this spring, I'm hoping to feature some stories (and citations).
#compchem
#opensource
#openscience
⚗️ Let me know:
discuss.avogadro.cc/t/avogadro-s...
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Avogadro Stories (for 2.0 Release)
As we finish up the 2.0 (final!) release, I’d like to feature some stories (and citations) about how Avogadro has shaped research and teaching. So if Avogadro has helped your research, please let me ...
https://discuss.avogadro.cc/t/avogadro-stories-for-2-0-release/7323?u=ghutchis
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Ashley Ringer McDonald
Justin Lemkul
26 days ago
Please join us for food and drink at the 2026 BPS meeting! Happening on Saturday. Plenty of tickets left!
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Ashley Ringer McDonald
Geoff Hutchison
about 1 month ago
Come join us in Pittsburgh this summer
#chemsky
- see why we've gotten great reviews from past REU students Have questions? Ask away...
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Applications are now open for the 2026 MolSSI ACT-CMS Faculty Fellowship. This fellowship supports faculty in molecular science disciplines who are developing curriculum to integrate cyberinfrastructure skills in the undergrad curriculum. Info session on Jan 30. More info:
act-cms.molssi.org#/home
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MolSSI ACT-CMS
https://act-cms.molssi.org/#/home
2 months ago
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Have any of you watched that show Chad Powers where a guy wears a disguise and pretends to be a college student so he can play football? Can I do that here? What would I need for an early career faculty member disguise anyway?
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2 months ago
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I don’t know that anyone in my network is a rattlesnake biologist, but I do know that my colleague
@emilytaylorscience.com
is awesome and does amazing work in conservation and education and if you DO happen to be an amazing rattlesnake biologist looking for a post-doc, you should definitely apply.
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3 months ago
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Ashley Ringer McDonald
C&EN (Chemical & Engineering News)
3 months ago
For the December
#Newscripts
,
@fmorningstar.bsky.social
took a look at the chemistry of two pop culture moments from the past year: An explosive scene in 28 Years Later and the GBBO sugar dome disaster. Read more:
cen.acs.org/education/sc...
#chemsky
đź§Ş
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Is this article about me?!? Did they know about the plastic wrap failure on the GBBO sugar dome thanks to my posts?!?!?
@fmorningstar.bsky.social
I am available for comment!!
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3 months ago
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Ashley Ringer McDonald
Nick Riley
4 months ago
Do you know outstanding undergraduate researchers who could use up to $1,000 in travel funding to present their work at the Spring
@acs.org
or
@pittcon.bsky.social
Meetings? Please encourage them to apply for a Kolthoff award! Deadline is Jan. 12, 2026.
acsanalytical.org/undergraduat...
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Awards for Undergraduate Students
Visit the post for more.
https://acsanalytical.org/undergraduate-awards/
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Omg, this is the most Baltimore thing to do ever.
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4 months ago
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Ashley Ringer McDonald
Miranda Andrews
4 months ago
Come be my colleague! We are hiring someone at the Asst. or Assoc. Prof. level to teach undergrad Physical Chemistry. The successful candidate is also encouraged to contribute their expertise to other new or existing courses at UIS.
@chemjobber.bsky.social
#chemsky
uis.csod.com/ux/ats/caree...
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Assistant or Associate Professor, Physical Chemistry
Summary:The School of Integrated Sciences, Sustainability and Public Health (ISP) in the College of Health, Science and Technology (CHST) at the Un...
https://uis.csod.com/ux/ats/careersite/1/home/requisition/1160?c=uis
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If anyone needs to know this, most plastic wrap in the US is made from polyethylene, but plastic wrap in Europe is made from PVC. This really matters if you are trying to make a decorative sugar dome for a cake after you saw them do it on a British baking show.
#chemsky
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4 months ago
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Ashley Ringer McDonald
Xuhui Huang
5 months ago
I received many requests to share materials from our undergraduate course “Machine Learning in Chemistry” — here you go! A preprint summarizing insights and lessons learned:
chemrxiv.org/engage/chemr...
A Jupyter Notebook Tutorial Gallery:
xuhuihuang.github.io/mlchem/html/...
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Note to self: decrease shrimp consumption for awhile. (Also, this article is super interesting.)
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5 months ago
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Undergraduate comp chemists! I know it’s a tough grad school climate right now, but here is someone great who is actively looking for 2-3 new students. Apply, apply, apply!!!
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6 months ago
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Be my colleague! Cal Poly San Luis Obispo is hiring two tenure-track positions for Fall 2026, chemical education and coatings technology. Chen Ed:
jobs.calpoly.edu/en-us/job/55...
Coatings:
jobs.calpoly.edu/en-us/job/55...
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Cal Poly - Details - Tenure Track Position - Chemistry
https://jobs.calpoly.edu/en-us/job/551372/tenure-track-position-chemistry
6 months ago
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Super interesting paper about students’ use of generative AI. They categorize four distinct type of AI use and discuss which types lead to productive use by students. (Not my paper, I just found it super interesting.)
pubs.acs.org/doi/10.1021/...
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Bridging Artificial Intelligence and Real Intelligence: Self-Scaffolding Computational Modeling with Generative AI in Chemistry
Chemistry education researchers have, for many years, explored different ways of learning chemistry through modeling and open-ended problem-solving. With the emergence of generative artificial intelli...
https://pubs.acs.org/doi/10.1021/acs.jchemed.5c00657
6 months ago
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Ashley Ringer McDonald
Marie van Staveren
6 months ago
Interested in chemistry grad school? Come check out the UMBC Chemistry Grad Open House! Department website:
chemistry.umbc.edu
Registration:
forms.gle/1ttSe3XrnaPq...
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The Women Make COMP symposium is back for the Spring 2026 ACS meeting! Undergraduate, graduate, and post-doctoral scholars are all eligible. Don’t miss this great opportunity to present your research and grow your professional network! Application:
docs.google.com/forms/d/e/1F...
7 months ago
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Ashley Ringer McDonald
Marie van Staveren
7 months ago
#ACSFall2025
Come see my talk about new Python notebooks for pchem (and more), giving students choice to get them to code, and why we should consider student identity when teaching programming. Room 140B at 4:55pm
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No one is talking about the fact that adiabatic is not accepted in spelling bee today? What are the rest of you doing on your flights to
#ACSFall2025
? (And no, I haven’t finished my slides yet. It’s a long way from the west coast to DC. I’ve still got plenty of time.)
7 months ago
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This is an excellent thread about some of the AI issues faculty should be thinking about this fall. I am by no means an AI hater, and I think a lot about what we should be teaching students about machine learning and generative AI. I think this is a very thoughtful piece.
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7 months ago
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Ashley Ringer McDonald
Emily Taylor
8 months ago
Calling all grades 3-5 teachers! (Many of you know one- share this with them)? We need your participation in Aug & Sept. And it is fun, ready to go, and a great learning opp! Curriculum:
rattlecam.org/rattle-ed
Please share.
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I went to the Lindau meeting when I was a 2nd year graduate student (way back in 2006!) and it is a truly amazing experience. I am so glad it is still going on, and I strongly encourage students to apply!!
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8 months ago
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I feel like I have been trying to spread this message for years and no one has been listening.
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8 months ago
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Ashley Ringer McDonald
Ceci Vollbrecht
8 months ago
Thrilled to have receive this fellowship to help add new skills to the chemistry curriculum that will help my students become better scientists! And thanks to the college for highlighting it!
www.kzoo.edu/news/faculty...
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That Computes: Faculty Member's Fellowship to Benefit Students
Cecilia Vollbrecht is one of just 10 faculty members from around the country to earn a fellowship that will help students learn new skills.
https://www.kzoo.edu/news/faculty-fellowship/
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Ashley Ringer McDonald
Chemjobber
8 months ago
Followers of the Church of Chemjobber, I'm delighted to endorse Dr. Chris Cramer for President of the United States in 2028. Now let us pray.
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Ashley Ringer McDonald
Carol Parish
9 months ago
URichmond is hiring two tenure-track faculty. One in biochemistry/chemical biology and the other in experimental physical chemistry. This is a terrific place to work - our focus is on our talented undergraduates and we have robust research resources.
chemistryjobs.acs.org/job/assistan...
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Ashley Ringer McDonald
Heidi Klem
9 months ago
The Klem Lab at LSU is hiring a postdoctoral researcher in computational biochemistry! Application info:
klem-research-group.github.io/join/
♻️ Please share with anyone who might be interested!
#chemjobs
#postdoc
#compchem
#biochemistry
#enzymes
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I know there is nothing yall love more than filling out the annual DFT poll!
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10 months ago
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I had so much fun being a judge at Cal Poly DataFest this afternoon! If you aren’t familiar with DataFest, it is a two-day undergrad competition where students find and tell a story in a dataset. All the students did amazing work! If your campus hosts a DataFest I highly recommend volunteering.
11 months ago
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Ashley Ringer McDonald
Needhi Bhalla 💅🏽
12 months ago
Hi all, I'm hiring a junior specialist/research technician for my lab at UCSC. An ideal applicant would be an undergraduate who would like more research experience before applying for grad school but all are welcome to apply đź§Ş
recruit.ucsc.edu/JPF01882
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Bhalla Lab - Research Specialist (Junior Specialist)
University of California, Santa Cruz is hiring. Apply now!
https://recruit.ucsc.edu/JPF01882
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Chemistry faculty: Want to upskill your programming skills and learn to incorporate programming in your curriculum? Apply for our workshop “Empower Your Curriculum with Python” held July 9-10, 2025 at Cal Poly in San Luis Obispo. Find out more and apply by May 15.
molssi.org/join-the-act...
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The Molecular Sciences Software Institution
This is the official website for MolSSI
https://molssi.org/join-the-act-cms-community-workshop-empower-your-teaching-with-python-programming/
12 months ago
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Ashley Ringer McDonald
12 months ago
🚨 PLEASE RT 🚨 Are you a comp chem trainee attending Spring ACS in San Diego? Would you like to expand your network with mentors in industry & academia at the COMP Mentor Lunch? Fill out this form if you are interested in attending!
forms.gle/Sq79TJihHnFW...
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https://forms.gle/Sq79TJihHnFW2MKLA
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Ashley Ringer McDonald
12 months ago
đź§Şđź“… The ACS COMP agenda for
#ACSSpring2025
is here! Get ready for cutting-edge sessions in computational chemistry. Scan the QR code to explore the full schedule 🔍👇
#ACSCOMP
#CompChem
#Cheminformatics
#DrugDiscovery
@chemsky.bsky.social
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Ashley Ringer McDonald
Chemjobber
about 1 year ago
This (ACS' communications to its councilors*) was useful to me, including clicking through the ACS presidential succession and what they were saying. ACS President-Elect Hernandez' statement is most relevant:
www.acs.org/about/govern...
#chemsky
⚗️🧪 *full disclosure: I am one** ** lol of like 400
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Councilor News & Committee Alerts - American Chemical Society
Councilor News & Committee Alerts is brought to you by the Office of the Secretary. This newsletter provides relevant information to Councilors and Committees.
https://www.acs.org/about/governance/councilor-news-and-committee-alerts.html
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I can’t wait to catch up with so many of you at the Saturday COMP Social at ACS! Check your email for the RSVP link. Tickets are limited so reserve yours ASAP!
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about 1 year ago
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@acscomp.bsky.social
is accepting applications for our Fall 2025 division awards! We have a great slate of awards recognizing outstanding grad students, post-docs, and junior faculty. Don’t forget you must be a COMP devision member to be eligible for division awards.
sites.google.com/site/acscomp...
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Awards
COMP Division Awards
https://sites.google.com/site/acscomptesting2019/awards
about 1 year ago
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If you are a grad student or post doc who is planning to apply for the MolSSI Software Fellowship this cycle, I highly recommend attending the info session this Thursday (March 7) from 3-4 pm ET to help you prepare a competitive application. Sign up ⬇️
molssi.typeform.com/to/ADPTw6bc?...
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Software Fellowship Info Session 2025
Turn data collection into an experience with Typeform. Create beautiful online forms, surveys, quizzes, and so much more. Try it for FREE.
https://molssi.typeform.com/to/ADPTw6bc?typeform-source=www.linkedin.com
about 1 year ago
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Ashley Ringer McDonald
Candace Winstead
about 1 year ago
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Ok, today is clearly not a funny day, but this is the funniest post on BlueSky maybe ever and I am literally the only person who has liked it.
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about 1 year ago
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I realized this weekend when I was talking to my mother-in-law that many people not only don’t realize that reducing grant indirect rates is bad, they think it could be good. As in “won’t you be able to get more grant money now that you won’t have to pay so much on this other stuff”
about 1 year ago
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Ashley Ringer McDonald
Volker Blum
about 1 year ago
#chemsky
#compchemsky
- MolSSI Fellowship competition to begin on Feb 15 -
molssi.org/fellowship/
- ACT-CMS Faculty Fellowship Applications are also open -
molssi.org/exciting-upd...
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The Molecular Sciences Software Institution
This is the official website for MolSSI
https://molssi.org/fellowship/
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Ashley Ringer McDonald
Derek Lowe
about 1 year ago
A long post about what’s happening to the science funding agencies in the US and why. As mentioned, this one just kept getting longer even as I kept stripping curse words from it.
www.science.org/content/blog...
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What's Happening Inside the NIH and NSF
https://www.science.org/content/blog-post/what-s-happening-inside-nih
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Ashley Ringer McDonald
Pitt Chemistry
about 1 year ago
Applications are open for our 2025 REU program! If you (or an undergraduate you know) are interested in a 10-week PAID research opportunity in our department, apply here by Feb. 15:
zurl.co/mmJiT
. More info:
zurl.co/rl4Zb
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Ashley Ringer McDonald
André K. Isaacs
about 1 year ago
Happy to announce I will be guest editing a special issue highlight PUI research! Please share
axial.acs.org/cross-discip...
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Call For Papers: Undergraduate Research as the Stimulus for Scientific Progress in the USA | ACS Publications Chemistry Blog
This Special Issue will highlight the significant research activities at Primarily Undergraduate Institutions (PUIs) in the United States and their unique focus on fostering student engagement in STEM...
https://axial.acs.org/cross-disciplinary-concepts/call-for-papers-undergraduate-research-as-the-stimulus-for-scientific-progress-in-the-usa
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Are you a faculty member who wants to incorporate Python programming in your chemistry classes?Come to our first MolSSI ACT-CMS curriculum showcase on Feb 3 at 4:30 pm ET. Two of our MolSSI faculty fellows will share examples for gen chem and pchem. Find out more and register at
act-cms.molssi.org
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MolSSI ACT-CMS
https://act-cms.molssi.org/
about 1 year ago
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