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Prajwal Nandekar, Ph.D. - Publications

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 simulations
Website:
https://sites.google.com/view/prajwalnandekar
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10 high-probability publications. We are testing a new system for linking publications to authors. You can help! If you notice any inaccuracies, please sign in and mark papers as correct or incorrect matches. If you identify any major omissions or other inaccuracies in the publication list, please let us know.

Year Citation  Score
2021 Mukherjee G, Nandekar PP, Wade RC. An electron transfer competent structural ensemble of membrane-bound cytochrome P450 1A1 and cytochrome P450 oxidoreductase. Communications Biology. 4: 55. PMID 33420418 DOI: 10.1038/s42003-020-01568-y  0.696
2020 Mustafa G, Nandekar PP, Mukherjee G, Bruce NJ, Wade RC. The Effect of Force-Field Parameters on Cytochrome P450-Membrane Interactions: Structure and Dynamics. Scientific Reports. 10: 7284. PMID 32350331 DOI: 10.1038/S41598-020-64129-7  0.674
2019 Mustafa G, Nandekar PP, Bruce NJ, Wade RC. Differing Membrane Interactions of Two Highly Similar Drug-Metabolizing Cytochrome P450 Isoforms: CYP 2C9 and CYP 2C19. International Journal of Molecular Sciences. 20. PMID 31487853 DOI: 10.3390/Ijms20184328  0.723
2019 Mustafa G, Nandekar PP, Camp TJ, Bruce NJ, Gregory MC, Sligar SG, Wade RC. Influence of Transmembrane Helix Mutations on Cytochrome P450-Membrane Interactions and Function. Biophysical Journal. PMID 30658838 DOI: 10.1016/J.Bpj.2018.12.014  0.72
2018 Douglas RG, Nandekar P, Aktories JE, Kumar H, Weber R, Sattler JM, Singer M, Lepper S, Sadiq SK, Wade RC, Frischknecht F. Inter-subunit interactions drive divergent dynamics in mammalian and Plasmodium actin filaments. Plos Biology. 16: e2005345. PMID 30011270 DOI: 10.1371/Journal.Pbio.2005345  0.5
2016 Kesharwani SS, Nandekar PP, Pragyan P, Rathod V, Sangamwar AT. 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. PMID 26916064 DOI: 10.1002/jmr.2537  0.374
2015 Mustafa G, Nandekar PP, Yu X, Wade RC. 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. PMID 26723624 DOI: 10.1063/1.4936909  0.7
2015 Yu X, Nandekar P, Mustafa G, Cojocaru V, Lepesheva GI, Wade RC. Ligand tunnels in T. brucei and human CYP51: Insights for parasite-specific drug design. Biochimica Et Biophysica Acta. 1860: 67-78. PMID 26493722 DOI: 10.1016/J.Bbagen.2015.10.015  0.622
2014 Kesharwani SS, Nandekar PP, Pragyan P, Sangamwar AT. Comparative proteomics among cytochrome p450 family 1 for differential substrate specificity. The Protein Journal. 33: 536-48. PMID 25331835 DOI: 10.1007/s10930-014-9586-6  0.363
2014 Rathod V, Jain S, Nandekar P, Sangamwar AT. Human pregnane X receptor: a novel target for anticancer drug development. Drug Discovery Today. 19: 63-70. PMID 23974067 DOI: 10.1016/J.Drudis.2013.08.009  0.39
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