PM
Employment
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Education
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Projects & Funding
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Development of computational models for various agonists/antagonists/inhibitors as anti-epileptic agents DST-INSPIRE2014 - Present
Publications (23)
- Virtual Screening, Synthesis and In Vitro Characterization of Histamine H4 Receptor Ligands Based on Pyrimidine Scaffolds Save
- Identification of CNS compatible small molecules as glycogen synthase kinase-3β (GSK-3β) inhibitors through structure-based virtual screening Save
- Structure-based virtual screening, biological assessment, and MD simulation studies of novel CNS compatible GSK-3β inhibitors as potential Alzheimer’s disease therapeutics. Save
- Simultaneous Method Development and Validation of Anastrozole Along with Piperine: Degradation Studies and Degradants Characterization Using LC-QTOF-ESI-MS Along with In-silico ADMET Predictions Save
- Antioxidant Activity of Novel Diosgenin Derivatives: Synthesis, Biological Evaluation, and in Silico Adme Prediction Save
- UHPLC-DAD Method Development and Validation: Degradation Kinetic, Stress Studies of Farnesol and Characterization of Degradation Products Using LC-QTOF-ESI-MS with in silico Pharmacokinetics and Toxicity Predictions Save
- Unexpected Reaction Products of Uracil and Its Methyl Derivatives with Acetic Anhydride and Methylene Chloride Save
- Discovery of thiazolidin-4-one analogue as selective GSK-3β inhibitor through structure based virtual screening Save
- Molecular Modeling of Histamine Receptors—Recent Advances in Drug Discovery Save
- Discovery and identification of putative adenosine kinase inhibitors as potential anti-epileptic agents from structural insights Save
- Enigmatic Histamine Receptor H4 for Potential Treatment of Multiple Inflammatory, Autoimmune, and Related Diseases Save
- Computationally guided identification of Akt-3, a serine/threonine kinase inhibitors: Insights from homology modelling, structure-based screening, molecular dynamics and quantum mechanical calculations Save
- Discovery of novel chemotypes for competitive AMPA receptor antagonists as potential antiepileptic agents through structure-based virtual screening of natural products library Save
- Identification of chemically diverse GABAA agonists as potential anti-epileptic agents using structure-guided virtual screening, ADMET, quantum mechanics and clinical validation through off-target analysis Save
- Molecular dynamics insights for PI3K-$δ$ inhibition & structure guided identification of novel PI3K-$δ$ inhibitors Save
- N-(4-Hydroxyphenyl)-3, 4, 5-trimethoxybenzamide derivatives as potential memory enhancers: synthesis, biological evaluation and molecular simulation studies Save
- Probing voltage sensing domain of KCNQ2 channel as a potential target to combat epilepsy: a comparative study Save
- High throughput virtual screening and in silico ADMET analysis for rapid and efficient identification of potential PAP 248-286 aggregation inhibitors as anti-HIV agents Save
- Identification of novel acetylcholinesterase inhibitors through e-pharmacophore-based virtual screening and molecular dynamics simulations Save
- Pharmacophore modeling, 3D-QSAR, and in silico ADME prediction of N-pyridyl and pyrimidine benzamides as potent antiepileptic agents Save