🔥The 9th Round of Easy Loan, Earn $40 Reward is in progress❗️ ⏰ Promotion Period: January 15th - Feburary 15th, 2025 👉 Register now and check more details at gate.io/campaigns/358

Folks please remember, when looking for a lab to join, always talk with current *and* past trainees. Joining a lab that nurtures and supports trainees is more important than where they publish. I cant stress that enough. Join a lab that will help guide you in your career

We want to thank Memorial Sloan Kettering Cancer Center Communication for helping us bring the stories behind our scientists and giving us an insight into the path that led them to do a postdoc at MSK. You can read their wonderful profiles on OneMSK: mskcc.sharepoint.com/SitePages/Cele… #NPAW2024

Registration is now open for the next CADD GRS, taking place at the University of Southern Maine July 12-13, 2025! Great opportunity for early career scientists interested in computer-aided drug design to present their work and network

Why Alphafold succeeded - the best large, curated, cleaned training data set is the PDB. Thank Helen Berman for that.

Big shout out to those researchers who made their data available in PDB over the years The Chemistry Nobel Prize winners today relied on that open academic data to train their models We wouldn't have these advances if researchers hadn't made 200,000 protein structures available

Running and Analyzing Massively Parallel Molecular Simulations 1. This article provides a comprehensive guide on generating and analyzing massively parallel molecular dynamics (MD) simulations to explore protein conformational landscapes and their role in biological processes.

The Conference for Undergraduate Women and Gender Minorities in Physics (CU*iP) application deadline is Oct 23rd! NYU is one of the host sites. Spread the word! aps.org/events/2025/un…

Excited to share my and Sonya's little guide to large parallel simulations (and what you can do with them) in preprint form!

wow, what an amazing and massively useful guide to large parallel simulations from Sukrit Singh and Sonya !!!! 🤩💻

Congrats Sukrit Singh & Sonya Hanson!

We can accelerate molecular conformational ensemble sampling with generative AI! Walk-Jump Sampling smoothes out the distribution by adding noise, and then samples on that smoothed manifold. Sampling in this noisy space can accelerate sampling by orders of magnitude!

Too many requests for money this Giving Tuesday? Consider giving your spare CPU/GPU cycles to advance biomedical research instead! Download our software and join our community of citizen scientists here: foldingathome.org/start-folding/

Exciting news! Our TS-DAR method is now published in Nature Communications! 🎉 TS-DAR identifies transition states across multiple free energy barriers in biomolecular dynamics—all at once! Paper: nature.com/articles/s4146… Code and tutorials: github.com/xuhuihuang/ts-…

Now published in J Phys Chem B! Check out our work showing that simulations predict the impact of distal mutations on kinase-inhibitor binding, and our experimental NanoBRET dataset of 94 kinase mutations that provide a benchmark for future methods. Link: pubs.acs.org/doi/10.1021/ac…

Ravikant Singh, 64, passes away. Knew him since 1987 when he was in Times of India and I was in Indian Express. We covered many events in the Capital and outstation. Well known in radio and TV circles. Travel well. Press Club of India #RavikantSingh

Shocked to learn of the passing away of Ravi Kant Singh who I worked with on so many broadcasts over the last 9 years. He was quite senior to us and had set strong ideas about many things but was always up for a chat and was always nice to me. His commentary prep notes were

The world of sports journalism has lost a true icon. Ravi Kant Singh, aged 64, passed away on Thursday, leaving behind a remarkable legacy in radio, television, and journalism. Our deepest condolences to the family 🙏

On Monday I took my Oath of Allegiance and became a Naturalized US Citizen!