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Journal of Biomolecular Structure & Dynamics|April 21, 2025
Bioactive fungal compounds as potential anti-HIV agents against HIV-1 protease: a multi-faceted molecular modelling approach for drug discoveryMadhusmita Panda, Priyanka Purohit, Debashis Barik, et al.
Journal of Biomolecular Structure & Dynamics|May 6, 2025
Computational structure-guided approach to simulate delamanid and pretomanid binding to mycobacterial F420 redox cycling proteins: identification of key determinants of resistanceGourav Chakraborty, Mahima Sudhir Kolpe, I V Ambily Nath, et al.
Journal of Biomolecular Structure & Dynamics|May 2, 2025
Evaluation of the structure and stability of myoglobin after interaction with ribose: spectroscopic and molecular simulation approachRasoul Eslami-Farsani, Sadegh Farhadian, Behzad Shareghi, et al.
Journal of Biomolecular Structure & Dynamics|June 16, 2025
Structural and antigenic variation in Hepatitis B virus oncogene, HBxFatima Fasih, Nusrat Jabeen, Mushtaq Hussain, et al.
Journal of Biomolecular Structure & Dynamics|May 31, 2025
Targeting Mycobacterium tuberculosis: identification of potential phytochemicals from traditional plants against glucosyl-3-phosphoglycerate phosphatase (GpgP)Pratyaksha Singh, Saurabh Kumar Bhati, Monika Jain, et al.
Journal of Biomolecular Structure & Dynamics|June 5, 2025
Exploring the anti-inflammatory potential of purified Plumbago zeylanica L. root extracts: an integrated in silico, in vitro, and in vivo approachNandita Mandal, Mousumi Paul, Yadu Nandan Dey, et al.
Journal of Biomolecular Structure & Dynamics|June 4, 2025
Bioprospecting potential, metabolic profiling, and molecular docking studies of metabolites from endophytic fungi associated with Teucrium stocksianumSajid Iqbal, Faisal Ahmad, Abdul Haleem, et al.
Journal of Biomolecular Structure & Dynamics|May 15, 2025
Identification of potential 3CLpro inhibitors-modulators for human norovirus infections through an advanced virtual screening approachShovonlal Bhowmick, Tapan Kumar Mistri, Mohammad K Okla, et al.
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