🚨 Admission Alert! 🚨 The JNCASR portal is reopening! 🕒 Check the post for detailed timings and seize this opportunity to be part of groundbreaking research! 🌟 #JNCASRAdmissions

For any who are interested in working on machine-learning driven simulations of battery electrolyes using path-integral techniques, I am opening a new postdoctoral position in my group. The Interfolio application site is here: apply.interfolio.com/167480

We are starting BS in Chemistry (4 yrs). This programme is fully loaded with state-of-the art Chemistry courses as well as cutting-edge technology-inclined courses, including AI/ML! Admission through JEE adv. Chemistry_IIT Delhi IIT Delhi

I’d be happy to host and mentor candidates applying for the ANRF National Post Doctoral Fellowship (N-PDF) in my group IIT Gandhinagar — RT appreciated. 🗓️ Call opens June 1 📩 DM or email [[email protected]] to discuss ideas! anirban.people.iitgn.ac.in

CECAM is thrilled to announce that Prof. Giulia Galli has been awarded the 2025 Berni J. Alder CECAM prize, for her transformative contributions to computational molecular science in the domain of novel methods for large-scale electronic structure & molecular dynamics simulations

If you have a good GATE AIR in Physics/Engg., and can code, and if you are interested in pursuing a 2+-year Master's degree (or Ph.D. for that matter), contact me.

In over half a century of research, Alexandra Navrotsky has made major contributions in mantle mineralogy, deep earth geophysics, and the thermodynamics behind mineral formation. She even lent her name to a recently discovered mineral—navrotskyite. cen.acs.org/physical-chemi…

🌟We are hiring! Seeking a postdoc to use molecular dynamics and AI to understand how ion channels are regulated by membrane lipids🌟 Join us at ourANU with amazing collaborators and great working conditions! Apply: tiny.cc/corry. Us: karri.anu.edu.au

Time’s running out! Lead generative AI research for molecular dynamics in our lab AIMLeNS. - Scale our NeurIPS/ICLR-published implicit transfer operators to revolutionize simulations. Postdoc position closes 10. July. Apply now: chalmers.se/en/about-chalm…

We're #hiring for multiple roles in our Computational Chemistry team at Aganitha (Hyderabad, India).

Annabella Selloni Retirement Symposium @ Frick Chemistry Laboratory, Princeton University Photos by: Kirsten Mahon Princeton University CST Temple

Editorial: 100 Years of Quantum Mechanics - All About Molecules | Journal of Chemical Theory and Computation pubs.acs.org/doi/full/10.10…

Not sure if any MSc(Physics) programme in India teaches Molecular Quantum Mechanics. Doubt it. Unfortunate.

Two full-time permanent *Scientific Assistant (B)* positions are available in the *Department of Chemical Sciences (DCS), TIFR Mumbai*. These positions are offered under the Goverment's CPC Pay Matrix Pay Level 6 tifrrecruitment.tifrh.res.in/applicants/Adv… tifrrecruitment.tifrh.res.in/applicants/app… Tata Institute of Fundamental Research

The registration for the NPTEL course “Machine Learning for Core Engineering Disciplines” ends on Monday, 4th August. Please see onlinecourses.nptel.ac.in/noc25_ge77/pre… for more details and to enrol for the course.

Work of Anjali Gaur & Nikhil V S Avula in JCIM & JCTC Journals. Machine-learned potential to model ethylene glycol. In crystal & gas phases, its C-C torsion is gauche. OTOH, in liquid, only 80% molecules are. We map its conformations, dipole moment over T with DPMD pubs.acs.org/doi/full/10.10…

MD simulations eat storage fast 🚨 With "compresstraj", we use Artificial Neural Networks to shrink trajectory data while preserving science — validated across diverse biomolecular systems 🧬💾 👉 Paper in JCIM: pubs.acs.org/doi/10.1021/ac… 💻 Code & tutorial: github.com/SerpentByte/co…

📢We are pleased to announce the 1st International Conference on Metal-Organic Frameworks and Porous Organic Polymers for Energy and Sustainability (MOFES'26) to be held at JNCASR, Bangalore from 12-15th January, 2026. Tapas K Maji BalasubramanianS JNCASR Bangalore MolMat Lab (Prof. Tapas K Maji's Group)

Is AI4Science stuck in a local minimum? 🤔 This question has been at the core of the discussions between Kevin M Jablonka and me for months, and the highlights are reflected in our comment “Real AI advances require collaboration” in Nature Reviews Chemistry 1/n nature.com/articles/s4157…

Dr. Klein has been elected to the Indian National Science Academy—one of the highest honors in the scientific community. Full list: insaindia.res.in/recent-elected… Indian National Science Academy (INSA) CST Temple Temple University