Arkanil Roy
Ph.D. Candidate Cisneros Research Group Department of Chemistry and Biochemistry University of Texas at Dallas
Based in Denton, United States
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About Arkanil Roy
🔬 Computational Biophysicist | Molecular Dynamics | Machine Learning for Structural Biology I specialize in molecular dynamics simulations and computational biophysics with a focus on studying enzyme dynamics ion interactions and structural transitions in biomolecular systems. My expertise includes advanced trajectory analysis enhanced sampling techniques and Markov state modeling to uncover key functional mechanisms. Beyond molecular simulations I work on method development for solving ill-posed problems in structural biology leveraging techniques like Tikhonov regularization and automated parameter selection. I also integrate sequence analysis approaches such as multiple sequence alignment to identify evolutionarily conserved residues critical to protein function. Passionate about applying computational techniques to advance drug discovery and biomedical research I thrive in interdisciplinary environments that bridge molecular modeling data science and machine learning.
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