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Journal of Molecular Graphics & Modelling|March 25, 2025
Exploring phytochemicals and marine natural products as alternative therapeutic agents targeting phosphotransacetylase (PTA) in Mycobacterium tuberculosis: An underexplored drug targetSneha Subramaniyan, Manikandan Jayaraman, Jeyakanthan JeyaramanComputational Biology and Chemistry|September 6, 2023
Multilayer precision-based screening of potential inhibitors targeting Mycobacterium tuberculosis acetate kinase using in silico approachesSneha Subramaniyan, Hemavathy Nagarajan, Umashankar Vetrivel, et al.Archives of Microbiology|August 22, 2025
Strategic targeting of AckA in Mycobacterium tuberculosis using peptide inhibitorsSneha Subramaniyan, Hemavathy Nagarajan, Richard Mariadasse, et al.Journal of Biomolecular Structure & Dynamics|December 11, 2024
Unveiling the oncological inhibition of bioactive compounds from <i>Adansonia digitata</i> via <i>in silico</i> analysis by targeting γ-butyrobetaine dioxygenase 1 against triple negative breast cancerP Sangavi, Hemavathy Nagarajan, Sneha Subramaniyan, et al.Journal of Biomolecular Structure & Dynamics|December 8, 2023
Harnessing allosteric inhibition: prioritizing LIMK2 inhibitors for targeted cancer therapy through pharmacophore-based virtual screening and essential molecular dynamicsRaghu Rangaswamy, Nagarajan Hemavathy, Sneha Subramaniyan, et al.Computers in Biology and Medicine|February 9, 2026
Probing the conserved catalytic mechanism of ThiL protein in pathogenic Leptospira species: An in silico strategy for inhibitor discovery to combat leptospirosisMaheswari Narthanareeswaran, Hemavathy Nagarajan, Sneha Subramaniyan, et al.The Journal of Membrane Biology|January 29, 2026
Targeting hORAI1-Mediated Calcium Influx in Triple-Negative Breast Cancer: A Computational Drug Discovery ApproachSangavi Pandi, Hemavathy Nagarajan, Sneha Subramaniyan, et al.Biochemical and Biophysical Research Communications|August 22, 2025
Integrated subtractive genomics and inhibitor identification of novel FAD-dependent monooxygenase in Nocardia farcinica JJSBBCNF_01Shaslinah Nathar, Hemavathy Nagarajan, Bhuvaneswari Narthanareeswaran, et al.Journal of Molecular Biology|February 3, 2026
Crystal structure of PH0140: Exogenous Amino Acids Induce Open Octameric Assembly Enables Promoter<sup>TTTT</sup> Binding for Transcription RegulationRichard Mariadasse, Mohammed Ahmad, Ravi Kant Pal, et al.Pageof 1