Diego Kleiman @KleimanDiego
Ph.D. candidate in Biophysics @ Shukla Group | University of Illinois | Molecular dynamics simulations 🧬 + ML 🤖. Now on 🦋 (@kleimandiego.bsky.social) Joined June 2022-
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Really happy to have taken part as a Binding Illini in @ShuklaGroup!
Really happy to have taken part as a Binding Illini in @ShuklaGroup!
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Diego Kleiman retweeted
ESMDynamic: A Fast and Accurate Prediction of Protein Dynamic Contact Maps from Single Sequences biorxiv.org/content/10.110… #biorxiv_biophys
Diego Kleiman retweeted
Thrilled for our Markov State Modeling (MSM) symposium at the ACS meeting this coming Sun (Mar 17) & Mon in Room R01! Join @drGregBowman, @CecClementi, & me for 28 exciting talks in-person or virtually! Huge thanks to @foldingathome for sponsoring! @ACSCOMP #ACSSpring2024
Diego Kleiman retweeted
Our holiday donations for the animal shelter run by Champaign Humane society are ready! @CUHumane @ChBEIllinois
Diego Kleiman retweeted
Join us for the thesis defense of Austin Weigle on Dec 14 at 9 am in RAL171 to learn about substrate selectivity of membrane sugar #transporters in #plants! DM us for the zoom link. @ShuklaGroup @ChemistryUIUC @ChBEIllinois
Diego Kleiman retweeted
#HighlightOfTheWeek Simulations to investigate DNA–DNA interactions in the presence of Mg ions. #compchem pubs.acs.org/doi/10.1021/ac…
Diego Kleiman retweeted
Check out our new manuscript explaining the difference between the effects of new psychoactive substances and classical cannabinoids on cannabinoid receptors. @ShuklaGroup We thank the @foldingathome donors for providing us computing time for this work.
Check out our new manuscript explaining the difference between the effects of new psychoactive substances and classical cannabinoids on cannabinoid receptors. @ShuklaGroup We thank the @foldingathome donors for providing us computing time for this work.
Diego Kleiman retweeted
Congratulations to all CCG Excellence Award Winners! 🏆🎉👏 #ACSFall2023 @ACSCOMP poster session #compchem
Diego Kleiman retweeted
Check out this JCTC special issue on Machine Learning for Molecular Simulation containing our group's paper by @KleimanDiego on Maximum Entropy Vampnets for adaptive sampling. Many thanks to the guest editors for the invitation. pubs.acs.org/doi/10.1021/ac…
Check out this JCTC special issue on Machine Learning for Molecular Simulation containing our group's paper by @KleimanDiego on Maximum Entropy Vampnets for adaptive sampling. Many thanks to the guest editors for the invitation. pubs.acs.org/doi/10.1021/ac…
Diego Kleiman retweeted
Our paper on committor learning and SHAP analysis conformational transitions is now out. doi.org/10.1063/5.0147…
Thank you to the @MolSSI_NSF for this fellowship and the @ShuklaGroup for the support! I am excited for the work that lies ahead!
Thank you to the @MolSSI_NSF for this fellowship and the @ShuklaGroup for the support! I am excited for the work that lies ahead!
Diego Kleiman retweeted
Group photo time for our group! We missed several group members especially undergrads. Thanks to Kathy @tstaggphoto @ChBEIllinois for taking the pictures!
Diego Kleiman retweeted
Congratulations to Krishna Narayanan for successfully defending his thesis on “Soluble decoy receptors for neutralization of viruses and their variants”. He is the first graduate from our group with an experimental thesis jointly supervised with Procko lab @MCB_Illinois
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