Read about our labmate and friend Roman Korol's thoughts on the situation in his native Ukraine and what he's doing to help. More info on how to contribute to relief efforts: its.caltech.edu/~rkorol/activi…

Best of luck, Tom!

Congratulations to grad students Xuecheng Tao and Lixue Cheng on their great PhD defenses last week and today! Best of luck in your next projects!

Check out postdoc Tomislav's and recent graduate Xuecheng Tao 's latest paper on Equilibrium–nonequilibrium ring-polymer molecular dynamics for nonlinear spectroscopy! Congrats, guys! aip.scitation.org/doi/full/10.10…

Check out Dan's latest paper on arxiv on Compact-to-Dendritic Transition in the Reactive Deposition of Brownian Particles! arxiv.org/abs/2204.01173

Congratulations to recent graduate Lixue Cheng and Jiace Sun on their latest paper! arxiv.org/abs/2204.09831

Congratulations on a great thesis defense today, Jorge! Jorge L. Rosa-Raíces We wish you all the best in your postdoc and beyond!

Please allow me to summarize some achievements of MOB-ML after 2019 here :) (1) MOB features are improved with an updated feature ordering & size-consistency aip.scitation.org/doi/abs/10.106…. We reach 1kcal/mol accuracy with 70 structures & apply MOB-ML to various challenging systems.

Congratulations to Daniel Jacobson on a great thesis defense today on Reactive Deposition of Brownian Particles! Best of luck in your future endeavors!

Check out the latest installment of the MOB-ML work from grad student Jiace Sun and recent graduate Lixue Cheng! arxiv.org/abs/2205.15510

Check out the latest collaboration of Lixue Cheng Jiace Sun, Sebastian Husch Lee and J. Emiliano Deustua with the McCoy group! pubs.acs.org/doi/abs/10.102…

Congratulations on a great defense today to James Lawniczak on Computational Investigations of Organometallic Catalysis! We wish you all the best!

Congratulations to recent graduate James and former postdoc Xinglong Zhang on their latest collaboration with the Agapie group! pubs.acs.org/doi/abs/10.102…

Excited to have this work published on JCTC JCTC Papers! We hope this work could also enlight the ML for electronic structure field on unsupervised learning & chemical space explorations pubs.acs.org/doi/10.1021/ac…

Congratulations to group alumni and graduate students Lixue Cheng, Jiace Sun, J. Emiliano Deustua and Vignesh Bhethanabotla on their latest MOB-ML paper! arxiv.org/abs/2207.08317

Check out Zhuoran Qiao / 乔卓然's latest paper, with Prof. Anima Anandkumar and Iambic Therapeutics pnas.org/doi/10.1073/pn…

Congrats Jiace Sun and Lixue Cheng!

Congrats Jiace Sun!

Congrats to James and Xinglong Zhang on their latest work on polyolefin catalysis! pubs.acs.org/doi/10.1021/ac…

Do you need advice with putting together your grad school application? CGSC and @caltechdici are back hosting another webinar answering all of your burning grad school application questions with help from current Caltech students 💬. 📅: Thursday, Nov. 3 ⏰: 9 am PST 📍: Zoom