Journal of Biomolecular Structure and Dynamics Time-dependent conformational analysis of ALK5-lumican complex in presence of graphene and graphene oxide employing molecular dynamics and MMPBSA calculation. By Sindhiya Sridharan, 4 years ago
Journal of Biomolecular Structure and Dynamics Exploring the dysregulated mRNAs–miRNAs–lncRNAs interactions associated to idiopathic non-obstructive azoospermia. By Soudabeh Sabetian, 4 years ago
Journal of Biomolecular Structure and Dynamics Interaction of esculetin with aluminium ion by spectroscopic studies and isothermal titration calorimetry: a probable molecule for chelation therapy. By Rupali G. Deokar, 4 years ago
Journal of Biomolecular Structure and Dynamics Molecular dynamics of hERG channel: insights into understanding the binding of small molecules for detuning cardiotoxicity. By Shruti Koulgi, 4 years ago
Journal of Biomolecular Structure and Dynamics RNA dependent RNA polymerase (RdRp) as a drug target for SARS-CoV2. By Avinash Mishra, 4 years ago
Journal of Biomolecular Structure and Dynamics Water-mediated structural rearrangement establishes active conformation of caspases for apoptosis and inflammation. By Anjaney Sharma, 4 years ago
Journal of Biomolecular Structure and Dynamics Physicochemical characterization of paclitaxel prodrugs with cytochrome 3A4 to correlate solubility and bioavailability implementing molecular docking and simulation studies. By Nupur S. Munjal, 4 years ago
Journal of Biomolecular Structure and Dynamics Molecular basis for the repurposing of histamine H2-receptor antagonist to treat COVID-19. By Ahmed A. Ishola, 4 years ago
Journal of Biomolecular Structure and Dynamics Immunomodulatory and anti-cytokine therapeutic potential of curcumin and its derivatives for treating COVID-19 – a computational modeling. By Hasnat Noor, 4 years ago
Journal of Biomolecular Structure and Dynamics Exploring potential inhibitor of SARS-CoV2 replicase from FDA approved drugs using insilico drug discovery methods. By Anshuman Chandra, 4 years ago