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Journal of Cellular Biochemistry|April 26, 2023
Structural insights into SARS-CoV-2 main protease conformational plasticityBudheswar Dehury, Sarbani Mishra, Sanghamitra PatiHeliyon|January 27, 2025
Extracellular domain of TREM2 possess two distinct ligand recognition sites: Insights from machine-learning guided docking and all-atoms molecular dynamics simulationsSarbani Mishra, Preety Sthutika Swain, Sanghamitra Pati, et al.International Journal of Biological Macromolecules|November 9, 2023
Lipid and cholesterols modulate the dynamics of SARS-CoV-2 viral ion channel ORF3a and its pathogenic variantsMadhusmita Rout, Sarbani Mishra, Sunita Panda, et al.Journal of Cellular Biochemistry|November 9, 2023
Illuminating the structural basis of human neurokinin 1 receptor (NK1R) antagonism through classical all-atoms molecular dynamics simulationsSarbani Mishra, Madhusmita Rout, Mahender Kumar Singh, et al.Computational Biology and Chemistry|April 28, 2024
Classical molecular dynamics simulation identifies catechingallate as a promising antiviral polyphenol against MPOX palmitoylated surface proteinSarbani Mishra, Madhusmita Rout, Mahender Kumar Singh, et al.The Journal of Physical Chemistry Letters|October 2, 2023
Dissecting the Molecular Basis of Host Leucine-Rich Repeat Containing 15 Mediated Interaction with Receptor Binding Domain of SARS-CoV-2 Spike Protein: A Computational ApproachSarbani Mishra, Mansi Sharma, Mahendra Kumar Singh, et al.International Journal of Biological Macromolecules|February 23, 2025
Starch scavenges degradation products from protein solutionsJaneka Gartia, Mandar Bopardikar, Budheswar Dehury, et al.Journal of Biomolecular Structure & Dynamics|December 27, 2023
Molecular docking and MD simulations reveal protease inhibitors block the catalytic residues in Prp8 intein of Aspergillus fumigatus: a potential target for antimycoticsSunita Panda, Madhusmita Rout, Sarbani Mishra, et al.Computers in Biology and Medicine|June 11, 2023
Exploiting the potential of natural polyphenols as antivirals against monkeypox envelope protein F13 using machine learning and all-atoms MD simulationsMadhusmita Rout, Sarbani Mishra, Suchanda Dey, et al.Journal of Cellular Biochemistry|January 3, 2025
Structural Dynamics of Neutral Amino Acid Transporter SLC6A19 in Simple and Complex Lipid BilayersBudheswar Dehury, Sarbani Mishra, Sunita Panda, et al.Pageof 2