Personal profile
Research Interests
- Computational Biophysics - Protein and peptide aggregation and self-assembly - Neurodegenrative disorders - Modelling biomolecular complexes - Drug design - Molecular dynamics simulations - Density functional theory
Teaching Interests
Biological Sciences at the interface of physics, chemistry and biology.
Biography
Dr Shayon Bhattacharya is an Associate Professor in the Department of Biological Sciences in the University of Limerick. He is a member of the Bernal Institute and is a deputy lead of the Bernal pillar Advanced Characterisation and AI-driven Technologies. Shayon also works with SSPC, the Research Ireland Centre for Pharmaceuticals. Shayon is an emerging leader in computational biophysics and peptide-based therapeutics, with an interdisciplinary background spanning molecular biophysics, computational chemistry and translational drug design. His research integrates molecular dynamics (MD) simulations, density functional theory (DFT) and machine learning to develop novel therapeutic strategies for neurodegenerative diseases, cancers and metabolic disorders. Shayon collaborates with leading experimental and industry partners in SSPC, European Framework, Research Ireland and Enterprise Ireland funded projects, actively leading or driving these multiple projects. His YouTube Channel runs molecular modelling tutorial sessions for newbies.
Related documents
Expertise related to UN Sustainable Development Goals
In 2015, UN member states agreed to 17 global Sustainable Development Goals (SDGs) to end poverty, protect the planet and ensure prosperity for all. This person’s work contributes towards the following SDG(s):
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SDG 3 Good Health and Well-being
Fingerprint
- 1 Similar Profiles
Collaborations and top research areas from the last five years
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A Mechanistic Study of Bio-Based Nanotemplated Carbon Nanofibers Derived From Water Processable Lignin Blends for Sustainable Energy Storage Applications
Miralda-Jalle, J., Haskouri, J. E., Bhattacharya, S., Beaucamp, A., Kennedy, T., Culebras, M. & Collins, M. N., 2026, (Accepted/In press) In: Advanced Materials.Research output: Contribution to journal › Article › peer-review
Open Access -
Differentiating Alzheimer's Aβ Isoforms Coaggregated in Cerebrospinal Fluid via Single-Particle Imaging
Henry, L., Bhattacharya, S., Bergaglio, T., Pinotsi, D. & Nirmalraj, P. N., 4 Feb 2026, In: ACS Chemical Neuroscience. 17, 3, p. 550-564 15 p.Research output: Contribution to journal › Article › peer-review
Open Access -
Ion-Mediated Adsorption of Amyloid-β Peptides at the Liquid/Liquid Interface: Insights from Electrochemistry and Molecular Dynamics Simulations
Holzinger, A., Bhattacharya, S., Wiloch-Szyborska, M. Z. & Jönsson-Niedziółka, M., 2 Jan 2026, In: ACS Electrochemistry.Research output: Contribution to journal › Article › peer-review
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Ion-Mediated Adsorption of Amyloid-β Peptides at the Biomimetic Liquid/Liquid Interface: Insights from Electrochemistry and MD Simulations
Holzinger, A., Bhattacharya, S., Wiloch, M. Z. & Jönsson-Niedziółka, M., 15 Jul 2025Research output: Other contribution
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Molecularly Engineered Memristors for Reconfigurable Neuromorphic Functionalities
Gaur, P., Kundu, B., Ghosh, P., Bhattacharya, S., Lohit, T., Harivignesh, S., Rath, S. P., Thompson, D., Goswami, S. & Goswami, S., 9 Dec 2025, (Accepted/In press) In: Advanced Materials.Research output: Contribution to journal › Article › peer-review
Activities
- 2 Membership of council
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Neuroscience Ireland (External organisation)
Bhattacharya, S. (Member)
2022Activity: Membership › Membership of council
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American Chemical Society (External organisation)
Bhattacharya, S. (Member)
1900Activity: Membership › Membership of council