Many thanks to our members John Vant Eric Wilson John Kevin Cava Nicholas Ho Chitrak Gupta @17Dsarkar Mrinal Shekhar Sumit @estreitwieser Fathima Doole Calvin Chun Kit Chan, Ph.D who work 24x7 to build a Research program !! Onto mid-tenure review with ASU School of Molecular Sciences :)

Our data-guided ensemble determination tool is now available online at Matter_CP. Great experience developing this tool with @17Dsarkar Mrinal Shekhar John Vant Genki Terashi Daisuke Kihara Kihara Laboratory Alberto Perez Emad Tajkhorshid, PhD Abhishek Singharoy sciencedirect.com/science/articl…

Featured in Matter_CP's October cover. Feels great to see this work finally get to fruition!

Cited in eurekalert!

Our new structure refinement pipeline is now featured by Florida News Times. Thanks Florida Times-Union!!!

#CryoFold is a data-guided tool for modeling molecular movements from cryo-EM density maps in #MatterIssue28! Collab led by Abhishek Singharoy w/Alberto Perez Daisuke Kihara Emad Tajkhorshid, PhD Mrinal Shekhar @Gterashi @17Dsarkar Chitrak Gupta John Vant & more Check it out: bit.ly/3EHKu3M

One of the most exciting projects I have ever worked on! Used my data science skills to discover trends in viral binding patterns. Thanks to Abhishek Singharoy and @GodulaKamil for this opportunity. Now published in Chem

We 💕#MolecularMotors! Mrinal Shekhar Chitrak Gupta #Murata modeled product release of #ATPase crystallographically confirmed new 'rotatory intermediate' propose a 4-step mechanism extending the 1998's Nobel-winning Boyer's model. biorxiv.org/content/10.110… Feedback plz !

First time since 2015. There is an in-person Biophysical Society Annual Meeting and I won't only be there in spirit. Will miss bumping into the familiar faces. Best wishes to all the attendees.

This is amazing!!!

Looking forward to speaking at the Marine Biology Lab at the beautiful Woods Hole, MA tomorrow !! To share new stories on electron transport in confined environments. Key contributors are Chitrak Gupta John Vant Umesh Khaniya and Calvin Chun Kit Chan, Ph.D

Just accepted ! In our 1st with ACS Central Science, Mrinal Shekhar Chitrak Gupta & #Chun combine, Metadynamics, BD & MFPT computations with X-tallography to find a potentially ubiquitous pathway for ATP hydrolysis product release out of catalytic pockets containing the 'Walker motifs'.

Had a great time meeting my postdoc mentor Abhishek Singharoy after 5 months. Amazing to learn how much the Singharoy group has achieved in such a short time!

Accepted ACS Central Science We combined atomistic MD, BD & MFPT with X-tallography to find pathway for product release following ATP hydrolysis. Shoutout to my mentor Abhishek Singharoy and coworkers Mrinal Shekhar and team #Murata pubs.acs.org/doi/full/10.10…

Thanks ACS Central Science for the shout out. Tagging key players of the story Mrinal Shekhar, Chitrak Gupta, Calvin Chun Kit Chan, Ph.D. Thanks Biodesign Institute at Arizona State University @ASUHPC @incite_lcf @XSEDEscience U.S. National Science Foundation !!

Great initiative by the Abhishek Singharoy group. Using remote viz to transform biotech education. Bringing life to the static, 2D images of biomolecules and unfurling the 3D, dynamic picture of biology.

Looking forward to exciting two days at the International Conference on Drug Discovery (ICDD) 2022. Great list of speakers from academia and industry. Thanks @Schrodinger and BITS Pilani, Goa for organizing such an amazing event.

Singharoy group going as strong as always...

Don't know how I missed this tweet. Great to see the collaboration with iMetabolic Biopharma Corporation that I initiated during my postdoc growing so nicely. Congratulations, team!