Bio-Data
Particulars of organization, functions and duties
Dr Selvaraman Nagamani
Designation : Scientist D
Education : Ph.D
ID. No.: EMP1293
Email id :
nagamani@neist.res.in
Research Interest
- Software Development, Machine Learning, Network Pharmacology.
- Bioinformatics, Computational Biology, AI / ML applications.
List of Publications(Most Recent Ones)
- Chutia, H., Borah, G. S., Mahanta, G.S., Nagamani, S*. BoostDILI: Extreme Gradient Boost-Powered Drug-Induced Liver Injury Prediction and Structural Alerts Generation. (2025) Chemical Research & Toxicology, 38(5), 865-876 (DOI: 10.1021/acs.chemrestox.4c00532).
- Borah, G. S., Nagamani, S*. (2024) Development of a robust machine learning model for Ames test outcome prediction. Chemical Physical Letters, 141663 (DOI: 10.1016/j.cplett.2024.141663).
- Priyadarsinee, L., Jamir, E., Nagamani, S., Mahanta, H. J., Kumar, N., John, L., ... & Sastry, G. N. (2024). Molecular Property Diagnostic Suite for COVID-19 (MPDSCOVID-19): an open-source disease-specific drug discovery portal. GigaByte, 14, 1-17 (DOI: 10.46471/gigabyte.114).
- Nagamani, S*., Jaiswal, L., & Sastry, G. N*. (2023). Deciphering the importance of MD descriptors in designing Vitamin D Receptor agonists and antagonists using machine learning. Journal of Molecular Graphics and Modelling, 118, 108346 (DOI:10.1016/j.jmgm.2022.108346)
- Nagamani, S., Karthikeyan, M. (2018) A theoretical insight to understand the molecular mechanism of dual target ligand CTA-018 in the chronic kidney disease pathogenesis. Plos One, 13(10): e0203194 (DOI: 10.1371/journal.pone.0203194).
Awards and Fellowship
- Selected from Japan Science and Technology Agency under Japan-Asia Youth Exchange program in Science (SAKURA Exchange Program in Science) to work in Ibaraki university for a period of one month (2018).
- National Post-Doctoral Fellowship (N-PDF) from the Department of Science and Technology (DST), Government of India, New Delhi, India (2017 – 2019). Prof. M.L. Khorana Memorial Prize for best paper in the field of Pharmaceutical & Medicinal Synthetic Chemistry, India (2014 & 2017).
- Indian Council of Medical Research - Senior Research Fellow (ICMR-SRF), Department of Health Research, Ministry of Health & Family Welfare, New Delhi, India (2014).
CSIR-North East
Institute of Science & Technology