NEW 🧵 A quick thread of charts showing how Trump’s economic agenda is going so far: 1) Trump has had the same impact on economic uncertainty as a global pandemic.

Donald Trump's first 100 days have been characterized by the most flagrant corruption imaginable. Today, I want to talk about 10 of the absolute worst examples. (Thread 🧵)

Belonging is about creating spaces where people aren't just included but are an integral part, where they feel they are meant to be, every day, not just during a designated week. It's about listening, learning, and adapting our environments to be truly welcoming for all.

Not sure why the gutting of American science funding isn’t a bigger story. No one voted for it, it reduces American innovation and economic competitiveness in the near-term and long-term, and it isn’t even being done efficiently, if that were in fact the goal.

The #CCPBioSim Biomolecular Simulation Annual Conference will be in Southampton, UK, 14-16 July 2025. Registration is open! Early-bird deadline: May 19 Details and the registration link can be found at ccpbiosim.ac.uk/events/upcomin… #compchem #biophysics

🚨 Check out the updated version of our latest preprint with Adrian Mulholland, Shakir Ali Siddiqui, [email protected], and many others! 📄 Read it here 👉chemrxiv.org/engage/chemrxi…

Our development of machine-learned transferable coarse-grained models in now on Nat Chem! doi.org/10.1038/s41557… I am so proud of my group for this work! Particularly first authors Nick Charron, Klara Bonneau, Aldo S. Pasos-Trejo, Andrea Guljas.

Great picture. Incredibly deceptive and ignorant argument. Of course cows don't "create" carbon atoms. But they do ensure that roughly 20,000,000,000,000,000,000,000,000,000,000,000,000,000 carbon atoms are in the atmosphere where they help heat the planet instead of in plants

Science literacy is collapsing. And with it, the foundations of civilization. People fear vaccines more than viruses. So diseases we once defeated are coming back. They fear GMOs more than hunger. So we reject tools that could feed millions. They fear nuclear more than climate

🎉 Our preprint “Dynamic Behavior ... of the Polymyxin Resistance Determinant MCR-1 ... in the Membrane Environment” in colab with Spencer Lab Adrian Mulholland [email protected] is now published in JCIM. 📖 Read it here: pubs.acs.org/doi/10.1021/ac…

I’m really happy to share that I’ve passed my PhD viva in Computational Biochemistry! It’s been an exciting journey and I’m profoundly grateful to my supervisors Dr [email protected] and Dr Deb Shoemark, and my collaborator Dr Richard Sessions for all their support and guidance.

WE’RE BAAACK!!! #BlackInChemWeek2025 is gearing up for kickoff next week! Join us as we celebrate six years with our community! 🎉🥳

Paging the #ChemEd and #CompChem communities: Could you please help my MSc student with an education project, exploring how gen AI shapes the way we think, solve problems, and build confidence.

It's #IndigenousPeoplesDay! Indigenous women and girls are keepers of invaluable scientific, environmental, and cultural knowledge. Yet, #AI systems often exclude or misrepresent them, reflecting colonial biases. To ensure inclusive AI governance, Indigenous women and girls

From QM/MM to ML/MM: A New Era in Multiscale Modeling 1. This review article explores the evolution from Quantum Mechanics/Molecular Mechanics (QM/MM) to Machine Learning/Molecular Mechanics (ML/MM) methods, highlighting how ML potentials offer a faster alternative to QM while

Latest ChemRxiv preprint! "Scalable Low-Energy Molecular Conformer Generation with Quantum Mechanical Accuracy" Collaboration w/ NVIDIA Healthcare We created ChEMBL3D, largest dataset of molecular 3D structures with 250M+ conformers for 1.8M drug-like molecules from ChEMBL. All

Today marks National Women's Equality Day. Celebrated every August 26th, the day commemorates the adoption of the nineteenth amendment to the United States Constitution in 1920. #WomensEqualityDay #RaceEqualityMatters #EveryActionCounts

PhD project with GW4 BioMed DTP available (Sept '26)! Use #compchem multiscale reaction simulations & experiment to understand and combat antimicrobial resistance by Class C beta-lactamase #enzymes. More info: gw4biomed.ac.uk/overcoming-%ce… Deadline Oct 20th, but contact me by Oct 5th.

Learning and understanding racism from a young age, whether that's through education settings or at home, is vitally important. Share this with parents, teachers, tutors & professors. ➡️ Join the REM network: lnkd.in/dvGtZNm #RaceEqualityMatters #ActionNotJustWords

bioRxiv has a dedicated section for negative results. Use it. Share negative results. Your colleagues will appreciate it.