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Publications (25)
- Antimicrobial and Anthelmintic Potential of Premna barbata: In Vitro and In Silico Insights Save
- Integrated network pharmacology, molecular docking and MD simulation unravel neuroprotective phytochemicals from aframomum melegueta targeting microglial neuroinflammation in Alzheimer’s disease Save
- Exploring Potential COX‐2 Inhibitors of Ibuprofen Derivatives: Integrating DFT, Molecular Docking, Molecular Dynamics Simulations, ADMET with FEL and MMPBSA Analyses Save
- Identification of primary amoebic meningoencephalitis inhibitor using pharmacophore modeling molecular docking MD simulation and pharmacokinetic behavior analysis Save
- Virtual Screening, Molecular Docking, MD Simulation, MMPBSA, and DFT Analysis of Marine Drugs in search of molecules effective against KRAS Mutation Save
- Current understanding of primary amoebic meningoencephalitis: Recent advancement pathogenesis diagnostics and treatment Save
- Exploring marine-derived bioactive compounds for dual inhibition of Pseudomonas aeruginosa LpxA and LpxD: integrated bioinformatics and cheminformatics approaches Save
- Natural Flavonoids as Primary Amoebic Meningoencephalitis Inhibitor: Virtual Screening, Molecular Docking, MD Simulation, MMPBSA, Density Functional Theory, Principal Component, and Gibbs Free Energy Landscape Analyses Save
- Electronic Features and Pharmacological Potentials of Substituted Thiazines Save
- Relationship Between Occurrence of Neurological Disorders and Coronavirus Infection via Protein-Protein Sequence Matching Analysis Technique and Repurposing Neuroprotective Agents in the Treatment of Coronavirus Infection Save
- Exploring Recent Advancements in the Pharmacological Activities of Plant-derived Alkaloids and Glycosides: A Review Save
- Computational Investigation of the Unveils NSD2 Inhibition Potential of Berberis vulgaris, Sambucus nigra, and Morus alba through Virtual Screening, Molecular Docking, MD Simulation, and DFT Analyses Save
- In-vitro antibacterial activity, Molecular docking, and MD Simulation Analysis of Phytoconstituents of Nasturtium officinale Save
- Polypharmacological and Computational Approaches to Establish HDAC Inhibitors in the Treatment of Alzheimer Save
- Molecular docking MD Simulation Synthesis DFT and Biological Evaluations of Newer Generation Imidazolo-Triazole Hydroxamic Acid linked with Para nitro Phenyl group Save
- Synthesis, spectral characterization, biological, FMO, MEP, molecular docking, and molecular dynamics simulation studies of cytidine derivatives as antimicrobial and anticancer agents Save
- Flavonoids as potential KRAS inhibitors: DFT, molecular docking, molecular dynamics simulation and ADMET analyses Save
- Pharmacophore Modeling Virtual Screening Molecular Docking DFT and ADMET Analyses to Develop Newer generation Dual Orexin Receptor Antagonist Targeting Insomnia Save
- Sleep Disorder and its Treatment: From Nature to Laboratory Save
- Geographical Distribution, Chemical Constituents, and Activity Profile of Magnolia Save