Prajwal Nandekar, Ph.D.
Affiliations: | 2015-2017 | MCM | Heidelberg Institute for Theoretical Studies HITS gGmbH |
| 2017-2019 | ZMBH | Heidelberg University, Germany | |
| 2019- | Scientist | Schrodinger Inc. |
Area:
Computer-aided drug design, molecular simulationsWebsite:
https://sites.google.com/view/prajwalnandekarGoogle:
"Prajwal Nandekar"Bio:
Prajwal Nandekar, Ph.D. Pharmaceutical Sciences (Pharmacoinformatics)
4 years of postdoctoral research experience in computational biophysics and computer‑aided drug design at Heidelberg University, Germany with Prof. Dr. Rebecca Wade.
Ph.D. in Pharmaceutical Sciences from National Institute of Pharmaceutical Education and Research (NIPER), India.
DAAD fellow for sandwich Ph.D. program.
Experienced in project management and mentoring students.
26 research publications in peer-reviewed international journals with h-index of 9, 246 citations and total impact factor 82.
Parents
Sign in to add mentor| Rebecca C Wade | post-doc | 2015-2019 | Heidelberg Institute for Theoretical Studies HITS gGmbH | |
| (Later, joined Schrödinger Inc. Bangalore as a Scientist) | ||||
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Publications
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| Mukherjee G, Nandekar PP, Wade RC. (2021) An electron transfer competent structural ensemble of membrane-bound cytochrome P450 1A1 and cytochrome P450 oxidoreductase. Communications Biology. 4: 55 |
| Mustafa G, Nandekar PP, Mukherjee G, et al. (2020) The Effect of Force-Field Parameters on Cytochrome P450-Membrane Interactions: Structure and Dynamics. Scientific Reports. 10: 7284 |
| Mustafa G, Nandekar PP, Bruce NJ, et al. (2019) Differing Membrane Interactions of Two Highly Similar Drug-Metabolizing Cytochrome P450 Isoforms: CYP 2C9 and CYP 2C19. International Journal of Molecular Sciences. 20 |
| Mustafa G, Nandekar PP, Camp TJ, et al. (2019) Influence of Transmembrane Helix Mutations on Cytochrome P450-Membrane Interactions and Function. Biophysical Journal |
| Douglas RG, Nandekar P, Aktories JE, et al. (2018) Inter-subunit interactions drive divergent dynamics in mammalian and Plasmodium actin filaments. Plos Biology. 16: e2005345 |
| Kesharwani SS, Nandekar PP, Pragyan P, et al. (2016) Characterization of differences in substrate specificity among CYP1A1, CYP1A2 and CYP1B1: an integrated approach employing molecular docking and molecular dynamics simulations. Journal of Molecular Recognition : Jmr. 29: 370-90 |
| Mustafa G, Nandekar PP, Yu X, et al. (2015) On the application of the MARTINI coarse-grained model to immersion of a protein in a phospholipid bilayer. The Journal of Chemical Physics. 143: 243139 |
| Yu X, Nandekar P, Mustafa G, et al. (2015) Ligand tunnels in T. brucei and human CYP51: Insights for parasite-specific drug design. Biochimica Et Biophysica Acta. 1860: 67-78 |
| Kesharwani SS, Nandekar PP, Pragyan P, et al. (2014) Comparative proteomics among cytochrome p450 family 1 for differential substrate specificity. The Protein Journal. 33: 536-48 |
| Rathod V, Jain S, Nandekar P, et al. (2014) Human pregnane X receptor: a novel target for anticancer drug development. Drug Discovery Today. 19: 63-70 |