Md Fulbabu Sk
Beckman Institute · University of Illinois
https://researchid.co/fulbabu
@illinois.edu
32Scopus Publications
859Google Scholar Citations
15Google Scholar h-index
20Google Scholar i10-index
Biography
I am a theoretical and computational biophysicist working at the interface of biology, chemistry, and biophysics. My research primarily focuses on biomolecular interactions, dynamics, structure, and thermodynamics. My systems of interest mainly include proteins, nucleic acids, and lipids. Additionally, I am also interested in machine learning and generative artificial intelligence (AI) for computer-aided drug discovery. Molecular dynamics simulations and statistical mechanics form the backbone of my research.
Recent Scopus Publications
- Unlocking the Conformational Secrets of DYRK1A Kinase With Computational Microscope: Exploring Phosphorylation-Driven Structural Dynamics
- Dynamic Interplay of Loop Motions Governs the Molecular Level Regulatory Dynamics in Spleen Tyrosine Kinase: Insights from Molecular Dynamics Simulations
- Structure of the human dopamine transporter and mechanisms of inhibition
- Microsecond dynamics of H10N7 influenza neuraminidase reveals the plasticity of loop regions and drug resistance due to the R292K mutation
- Deciphering the molecular choreography of Janus kinase 2 inhibition via Gaussian accelerated molecular dynamics simulations: a dynamic odyssey
Links
- ORCID https://orcid.org/0000-0003-4341-8370
- Google Scholar https://scholar.google.com/citations?user=hH9eGJUAAAAJ
- Scopus https://www.scopus.com/authid/detail.uri?authorId=57211267643