40 results on '"Dowerah, Dikshita"'
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2. Binding patterns of derivatives of fisetin and chrysin to the enzyme complex cyclin-dependent kinase 6/cyclin D
3. Reverse vaccinology and immunoinformatics approach to design a chimeric epitope vaccine against Orientia tsutsugamushi
4. Structure and Stability of (CeO2)n0,±1 (n=1-3) Clusters towards the Adsorption and Co-adsorption of CO and H2O from DFT Study
5. Termolecular Eley–Rideal pathway for catalytic oxidation of nitric oxide on [Pt2]0,± dimers using O2
6. Inhibitory potential of furanocoumarins against cyclin dependent kinase 4 using integrated docking, molecular dynamics and ONIOM methods
7. Oxidation pathways and kinetics of the 1,1,2,3-tetrafluoropropene (CF2CF–CH2F) reaction with Cl-atoms and subsequent aerial degradation of its product radicals in the presence of NO
8. Structural insight into locked nucleic acid based novel antisense modifications: A DFT calculations at monomer and MD simulations at oligomer level
9. Termolecular Eley–Rideal pathway for catalytic oxidation of nitric oxide on [Pt2]0,± dimers using O2.
10. Oxidation pathways and kinetics of the 1,1,2,3-tetrafluoropropene (CF2=CF–CH2F) reaction with Cl-atoms and subsequent aerial degradation of its product radicals in the presence of NO.
11. Tuning the Reaction Mechanism toward Selective Hydrogenation of CO2 to Formic Acid on a Sn10O20 Cluster
12. Reverse vaccinology and immunoinformatics approach to design a chimeric epitope vaccine against Orientia tsutsugamushi
13. Reaction Mechanism and Kinetics for the Selective Hydrogenation of Carbon Dioxide to Formic Acid and Methanol over the [Cu2]0,±1 Dimer
14. Inhibitory Potential of Furanocoumarins Against Cyclin Dependent Kinase 4 Using Integrated Docking, MD and ONIOM Methods
15. Partial Oxidation of Methane to Methanol by Using Molecular O2 on Pd2+ Catalyst: An Insight from Theory
16. Tuning the Reaction Mechanism toward Selective Hydrogenation of CO2 to Formic Acid on a Sn10O20 Cluster.
17. Reaction Mechanism and Kinetics for the Selective Hydrogenation of Carbon Dioxide to Formic Acid and Methanol over the [Cu2]0,±1 Dimer.
18. Tropospheric Oxidation of 1,1,2,3-Tetrafluoropropene (CF2=CF–CH2F) Initiated by ·OH Radical and Aerial Degradation of Its Product Radicals
19. Oxido- and mixed-ligand peroxido complexes of niobium(v) as potent phosphatase inhibitors and efficient catalysts for eco-friendly styrene epoxidation
20. Tuning the Reaction Mechanism toward Selective Hydrogenation of CO2to Formic Acid on a Sn10O20Cluster
21. Partial Oxidation of Methane to Methanol by Using Molecular O2 on Pd2+ Catalyst: An Insight from Theory.
22. Mechanistic Details of Catalytic Hydrogenation of CO 2 to Useful Chemicals Using SnO 2 Clusters
23. Design of LNA Analogues Using a Combined Density Functional Theory and Molecular Dynamics Approach for RNA Therapeutics.
24. Physical Properties, UV Stability, Biodegradability, and DFT Study of Chicken Feather Fiber Based Composites Crosslinked with Rosin Derivative
25. Tropospheric Oxidation of 1,1,2,3-Tetrafluoropropene (CF2=CF–CH2F) Initiated by ·OH Radical and Aerial Degradation of Its Product Radicals.
26. Development of multi-epitope chimeric antigens for scrub typhus diagnostics and vaccines: An in-silico investigation
27. Structure, Stability and Reactivity of (Ceo2)N0,±1 (N=1, 2) Clusters Towards the Adsorption and Co-Adsorption of Co and H2o from Dft Study
28. Immunoinformatics mapping of potential epitopes in SARS-CoV-2 structural proteins
29. Catalytic oxidation of NO to NO2 on pure and doped AunPt3-n (n=0–3) clusters: A DFT perspective
30. Tuning the transition barrier of H2 dissociation in the hydrogenation of CO2 to formic acid on Ti-doped Sn2O4 clusters
31. Quantum Chemical Calculations on Locked Nucleic Acid based Modifications: A Density Functional Theory (DFT) Study
32. Quantum Chemical Calculations on Locked Nucleic Acid based Antisense Modifications: A Density Functional Theory (DFT) Study at Monomer Level
33. Unveiling the Role of Hydrogen Bonding and g-Tensor in the Interaction of Ru-Bis-DMSO with Amino Acid Residue and Human Serum Albumin
34. Tuning the transition barrier of H2 dissociation in the hydrogenation of CO2 to formic acid on Ti-doped Sn2O4 clusters.
35. Unveiling the Role of Hydrogen Bonding and g‑Tensor in the Interaction of Ru-Bis-DMSO with Amino Acid Residue and Human Serum Albumin.
36. Structure and Stability of (CeO2)n0,±1(n=1-3) Clusters towards the Adsorption and Co-adsorption of CO and H2O from DFT Study
37. Termolecular Eley–Rideal pathway for catalytic oxidation of nitric oxide on [Pt2]0,± dimers using O2.
38. Oxidation pathways and kinetics of the 1,1,2,3-tetrafluoropropene (CF 2 CF-CH 2 F) reaction with Cl-atoms and subsequent aerial degradation of its product radicals in the presence of NO.
39. Reaction Mechanism and Kinetics for the Selective Hydrogenation of Carbon Dioxide to Formic Acid and Methanol over the [Cu 2 ] 0,±1 Dimer.
40. Tuning the transition barrier of H 2 dissociation in the hydrogenation of CO 2 to formic acid on Ti-doped Sn 2 O 4 clusters.
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