All Publications

S. Nudrat, S. Maity, S. Khare, K. Kumari, M. Jana, and A.,"Construing the Interactions of Coumarin Derivatives with the Main Protease of Stomach Pepsin Using Spectroscopic and Computational Analyses: Insights into the Binding Thermodynamics, Antifibrillation Studies, and Enzymatic Assay", ACS Food Sci. Technol., vol.4, pp.245–262, ACS 2024, https://doi.org/10.1021/acsfoodscitech.3c00495       Article

P. Giri, S. B. V, S. Dhurua, S. Maity, R. Gazi, and M. Jana,"Boron-containing fullerene-based salts with cyclic carbonate solvents as electrolytes for Li-ion batteries and beyond", Phys. Chem. Chem. Phys., vol.26, pp.9317-9328, RSC, February 2024, 10.1039/D3CP04706G       Article

S. Lyndem, P. Giri, A., A. Bhatta, M. Jana, A. S. Roy, and K. Kumari,"Inhibition of amyloid formation of bovine hemoglobin by bioactive phenolic acids: an elaborate investigation into their binding properties with the protein using multi-spectroscopic and computational techniques", New J. Chem.,, vol.48, pp.12362-12386, RSC, June 2024, 10.1039/D4NJ01106F       Article

S. Maity, S. Pahari, S. Santra, and M. Jana,"Interfacial Glucose to Regulate Hydrated Lipid Bilayer Properties: Influence of Concentrations", J. Chem. Inf. Model., vol.64, pp.3841–3854, ACS, April 2024, https://doi.org/10.1021/acs.jcim.3c01991       Article

S. Das, M. Jana, V. K. Belwal, A. S. Roy, S. Nudrat, and S. Maity,"Isoflavones and lysozyme interplay: Molecular insights into binding mechanisms and inhibitory efficacies of isoflavones against protein modification", Chemical Physics Impact, vol.8, pp.100643, Elsevier, June 2024, https://doi.org/10.1016/j.chphi.2024.100643       Article

S. Nudrat, B. Maity, S. Quraishi, I. Karankumar, K. Kumari, M. Jana, and A.,"Binding interaction of coumarin derivative daphnetin with ovalbumin: molecular insights into the complexation process and effects of metal ions and pH in the binding and antifibrillation studies", Molecular Pharmaceutics, vol.21, no.9, pp.4708-4725, ACS Publications, August 2024, 10.1021/acs.molpharmaceut.4c00675       Article

S. Dhurua and M. Jana,"Conformational preferences of heparan sulfate to recognize the CXCL8 dimer in aqueous medium: degree of sulfation and hydrogen bonds", Physical Chemistry Chemical Physics, vol.26, no.32, pp.21888-21904, RSC 2024, 10.1039/D4CP01430H       Article

S. Dhurua, S. Maity, B. Maity, and M. Jana,"Comparative bindings of glycosaminoglycans with CXCL8 monomer and dimer: insights from conformational dynamics and kinetics of hydrogen bonds", The Journal of Physical Chemistry B, vol.128, no.42, pp.10348–10362, ACS, October 2024, 10.1021/acs.jpcb.4c03670       Article

B. Halder, A. Mitra, S. Dewangan, R. Gazi, N. Sarkar, M. Jana, and S. Chatterjee,"Solid state synthesis of bispyridyl-ferrocene conjugates with unusual site selective 1,4-Michael addition, as potential inhibitor and electrochemical probe for fibrillation in amyloidogenic protein", Journal of Molecular Structure, vol.1273, no.134362, Elsevier, February 2023, 10.1016/j.molstruc.2022.134362       Article

S. Dhurua and M. Jana,"Understanding Conformational Properties and Role of Hydrogen Bonds in Glycosaminoglycans-Interleukin8 Complexes in Aqueous Medium by Molecular Dynamics Simulation", ChemPhysChem, vol.24, no.4, Willey, February 2023, 10.1002/cphc.202200440       Article