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And with the stroke of midnight, I'm no longer Department Chair. It's been an adventure, but I'm happy to return to the work of a regular faculty member! youtube.com/shorts/_zr1cVi…

Thanks, Christoph. Excellent meeting at the RESOLV Cluster, and great to be back in Bochum.

Our paper in JCTC on constant-pH simulations via enhanced sampling with Abbvie collaborators is now available open access. Any and all feedback welcome. pubs.acs.org/doi/10.1021/ac…

After years of effort, our paper on rapid prediction of molecular crystal structures using topological and simple physical descriptors is available at Nature Comm. Praise goes to N. Galanakis, a truly excellent postdoc: rdcu.be/dZRSh

Join us for the 2024 Ned Seeman Memorial Mini-Symposium on December 9, 2024 as.nyu.edu/departments/ch…

The Simons Center for Computational Physical Chemistry (SCCPC) at NYU is announcing another round of independent postdoctoral fellowship applications due March 1, 2025. For more information see: wp.nyu.edu/sccpc/independ…

Our paper reporting a combined theoretical/experimental study of a new class of deep eutectic solvents is out in JPCB. We still need to name these liquids following the pattern introduced by Abbott. Any suggestions? pubs.acs.org/articlesonrequ…

Dear X-followers: Please join me on bluesky under the handle Tuckerman Group (@grouptuckerman.blsky.social).

I just began reading David Limmer's new book on Statistical Mechanics and Stochastic Thermodynamics. Truly excellent book with very clear explanations of the concepts. I highly recommend it!

Preparing to attend the RARE meeting in Khajuraho, India next week: sites.google.com/view/rare2025/…

For anyone interested in an AI hackathon: elucidata.io/elhackathon-20…

Our paper in Applied Physics Reviews on ML versus MM force fields is now out. Kudos to Yuanqing for spearheading the effort to produce this. pubs.aip.org/aip/apr/articl…

Glad to see that this symposium honoring John Perdew is happening at Temple University.

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

Our paper on the use of enhanced sampling to compare different RNA force fields, including HB-CUFIX, is now available. Kudos to Akshaya on the great work. pubs.aip.org/aip/jcp/articl…

Congratulations to Giulia Galli on winning the 2025 Berni Alder Prize!

Our paper combining d-AFED/TAMD with REST2 is now out. Thus, we have an approach to handle both energetic and entropic barriers in complex systems. pubs.acs.org/doi/10.1021/ac…

Nadya Mason, dean of the Pritzker School of Engineering at U. Chicago gave a terrific interview with Physics World Weekly on research at the PME. The podcast also has an interview with Jeffrey Spangenberger at ANL on battery recycling. Great listening: podcasts.apple.com/us/podcast/mol…