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Computational Chemistry & Biophysics Lab

Latest news &  updates

1. Congratulations to Anandita Mitra for receiving best poster and Dr. R. S. Daryan Young Scientist Award in Society of Physical Chemistry Symposium-2025 held at IIT Patna.  

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2. Congratulations to Prof. Sandip Paul for being recognized as an Editorial Board Member of Scientific Reports. 

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3. Kudos to Madhusmita Devi on having their article selected as the Cover Feature of the Journal of Physical Chemistry B.

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​4. Pleased to share that the work of Mira Jhawar has been highlighted as the Cover Feature in ChemPhysChem. 

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Research Interests

Our research focuses on Computational Biophysics and Chemistry, more specifically molecular dynamics simulations of biological macromolecules and their complexes with each other and with small molecules, such as:

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★ Protein Stabilization Mechanism.
★ Specific Disease Control Mechanism.
★ Lipophobic Drug Solubilization.
★ Controlled Drug Delivery.
★ Protein Aggregation
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