Shreshty Budakoti on Muck Rack

Shreshty Budakoti

As seen in: Science Magazine
Is this you? As a journalist, you can create a free Muck Rack account to customize your profile, list your contact preferences, and upload a portfolio of your best work. Claim your profile

Get in touch with Shreshty

Contact Shreshty, search articles and posts on X, monitor coverage, and track replies from one place.

Learn more about Muck Rack

Actions

Share this page

Is this you?

As a journalist, you can create a free Muck Rack account to customize your profile, list your contact preferences, and upload a portfolio of your best work.
Claim your profile

Articles

A diffusion-based framework for designing molecules in flexible protein pockets

|
By Kohei Matsuda, Rui Hirasawa, Abhimanyu Thakur, Jian Wang, Dong Zhang, Nikolay V. Dokholyan, Shreshty Budakoti
| Science Magazine Verified
Abstract Designing molecules for flexible protein pockets poses a substantial challenge in structure-based drug discovery, as proteins often undergo conformational changes upon ligand binding. While deep learning–based methods have shown promise in molecular generation, they typically treat protein pockets as rigid structures, limiting their ability to capture the dynamic nature of protein-ligand interactions.
Open in Who Shared Issue with article?
See all 1 articles
 •  Privacy  •  Terms  •  Security and Legal  •   •   •   • 

© 2026 Muck Rack

SOC 2® Certified