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Assistant Professor
Institute of Bioinformatics and Applied Biotechnology (IBAB)
Biotech Park, Electronics City Phase I, Bengaluru 560100
Research Interests
- Artificial Photosynthesis: Understanding the dynamics of electronic excitation energy transfer and vibronic coherences in photosynthetic light harvesting systems towards designing artificial harvesters.
- Photoprotection in biological systems: (a) Investigating photoprotective pathways in the eye lens crystallin family using classical, quantum and mixed quantum-classical methods.
- Noncovalent interactions: Characterising weak noncovalent interactions in biomolecules and their role in conformational transitions such as protein folding and liquid-liquid phase separation.
- Developing efficient fragment-based methods to model photophysical phenomena.
- An efficient implementation of the localized operator partitioning method for electronic energy transfer, J. Nagesh, A. F. Izmaylov, P. Brumer, The Journal of Chemical Physics 142, 084114 (2015).
- Fast numerical evaluation of time-derivative nonadiabatic couplings for mixed quantum–classical methods, I. G. Ryabinkin, J. Nagesh*, A. F. Izmaylov, The Journal of Physical Chemistry Letters 64200-4203, (2015).
- New Insights into the State Trapping of UV-Excited Thymine, L. Stojanović, S. Bai, J. Nagesh, A. F. Izmaylov, R. Crespo-Otero, H. Lischka, M. Barbatti, Molecules 21, 1603 (2016).
- Localized operator partitioning method for electronic excitation energies in the time-dependent density functional formalism, J. Nagesh, M. J. Frisch, P. Brumer, A. F. Izmaylov, The Journal of Chemical Physics 145, 244111 (2016).
- Origin of luminescence based detection of metal ions by Mn doped ZnS quantum dots, Trupthi Devaiah C., Bhagwati Sharma, Jayashree Nagesh†, Abhishek Sibu, Shyamashis Das, Kommula Bramhaiah, Nasani Rajendar, Neena S. John and Pralay K. Santra†, ChemistrySelect, 4, (2019) 13551.
- Increasing protein stability by engineering n->π* interaction at the β-turn, Bhavesh Khatri, Puja Majumdar, Jayashree Nagesh, Aravind Penmatsa† and Jayanta Chatterjee,† Chem. Sci., 11, (2020) 5480.
- Cross talk between overlap interactions in biomolecules: A case study of the β-turn motif, Jayashree Nagesh†, Molecules, 26, (2021) 1533.
- Satish Kumar, Kshetrimayum Borish, Sanjit Dey, Jayashree Nagesh†, Aloke Das†, Sequence dependent folding motifs of the secondary structures of Gly-Pro and Pro-Gly containing oligopeptides, Phys. Chem. Chem. Phys., 24, (2022) 18408
- Not all triplets are created equal: Parallel triplet formation pathways in a singlet fission material, Nilabja Maity*, Woojae Kim*, Naitik A. Panjwani, Arup Kundu, Kanad Majumder, Pranav Kasetty, Divij Mishra, Robert Bittl, Jayashree Nagesh†, Jyotishman Dasgupta†, Andrew J. Musser†, Satish Patil†, Nature Comm, 13, (2022) 5244.
- Computers in organic chemistry, Jayashree Nagesh†, Resonance, 28, (2023) 255.
Last update: 18 July 2023
