🔥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

Our 2nd piece on applied neurosciences+comput. bioenergetics. CryoEM+ Mass spec + BD shows big PTM-induced changes during Alzheimers propagation. *Upregulation of the Proto-Oncogene Src Kinase in Alzheimer’s Disease* biorxiv.org/content/10.110… Banner Health Biodesign Institute at Arizona State University

Out in Cell Systems, Method to find peptide binders from human proteome in 7 seconds ! Eric Wilson's best work :) 🙏Diego Chowell Access: hlainception.asu.edu:3000 Release: eurekalert.org/news-releases/… Paper: authors.elsevier.com/a/1ir1M8YyDfql… Biodesign Institute at Arizona State University Mayo Clinic Mount Sinai Health System

A bunch of new science articles are accepted. So releasing all the code now :) Particularly happy about releasing. *Resolution exchange-MDFF & simpleARBD* They will give you novel insights, almost guaranteed !! Big discoveries loading...

These EM-model challenges are an incredible resource to learn and hone tools. nature.com/articles/s4159… Big thanks to @17Dsarkar Mrinal Shekhar Alberto Perez arup mondal Sumit Christopher Rowley !! Our tools: cell.com/matter/pdf/S25…; ncbi.nlm.nih.gov/pmc/articles/P… 💕 Cathy & Wah !!

Requesting attention on Biophysical Journal's special volume for "Challenges in Bimolecular Simulations". Look forward to your enthusiastic participation ! Let's conceive some milestone computational problems in molecular+protein+cellular biophysics :) Rommie Amaro Tamar schlick

Follow-up of our Cell2019 & Taras's 2010 sims by Jonathan Nguyen, finding multiple docking sites on IM protein complex in his 1st J. Am. Chem. Soc.. Amazing single-molecule work by long-time partners from Sheffield (Neil, Matt and the entire 🏏 team) !! #computchem #bioenergetics

SMS's own Abhishek Singharoy recently published research in the Journal of the American Chemical Society titled Single-Molecule Detection of the Encounter and Productive Electron Transfer Complexes of a Photosynthetic Reaction Center. Read more: pubs.acs.org/doi/10.1021/ja…

Thanks BIOVIA for you generous support of our science over the years with the ambassadorship. Wish more power to #DiscoveryStudio & #MaterialsStudio !!

Out now with PekkurnazLab :) Way to go John Vant and #Howard. nature.com/articles/s4225…

New free energy sims of this 'molecular snowmobile' for bacterial movement by super-talented Jacob_Miratsky, working hands-on with trivedi & Abhishek Shrivastava (he/him/his). Check out the preprint here, and bestow us with feedback: biorxiv.org/content/10.110…

Voted in the crucial swing state of Arizona with Abhishek Singharoy

6 years and simulating 13 milliseconds later #Chun & #Jon finds how "Transient protein structure guides surface diffusion pathways for electron transport in membrane supercomplexes." researchsquare.com/article/rs-546…

The BPS Arizona Student Chapter Biophysical Society activities make me a really proud mentor !! Calendars coming soon :)

#JobOpening The group is looking for *2 new graduate students* in Computational Biophysics (QM/MM; MD; informatics, systems biology broadly defined) for start in the Fall, 2025. Plz apply to ASU School of Molecular Sciences, and prompt us in your app. RT & mail me app directly !

Wishing a Happy 2025 from the entire team ASU School of Molecular Sciences & Biodesign Institute at Arizona State University !! Sounds on for the background music. It synced remarkably well this time :)

Super proud of this work! Applied a series of in silico methods to investigate #mechanophore in collaboration with Abhi Singharoy Ross Wang Lab SERB #compchem cell.com/heliyon/fullte…

First paper of 2025 with Ross Wang Lab & #AlisonOndrus Here is a cute and practical technique by Sumit for studying reactions under external force, complementing #CoGEF methods. #compchem cell.com/heliyon/fullte… Heliyon ASU School of Molecular Sciences Chemistry at UIC

Group embarking on it's most exciting program, combining proteome/cell-scale (100 M atom+) simulations with deep leaning !! Immediately seeking researcher scientists with experience, offering 6-figure salary..need to recruit in ASAP. Requesting DM & RT !!

🚨 New in multiple myeloma research! 🚨 We discovered a novel cereblon variant with dual exon 8 & 10 deletions in newly diagnosed and relapsed MM patients. This alteration compromises IMiD drug efficacy by disrupting E3 ligase function. 🧬 Molecular modeling + wet lab

We introduce HLA-Inception, a deep learning model that predicts MHC-I peptide binding motifs using only electrostatic features of the binding pocket—offering a physics-based alternative to traditional sequence-based approaches. Trained on just 133 alleles, the model generalized