Publications - 114Publications - 114
Publications - 114Publications (114)
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ArticlesAssociation of Nucleobases in Hydrated Ionic Liquid from Biased Molecular Dynamics Simulations2018 | American Chemical Society- ArticlesNondiffusive Rotational Jump Dynamics in Ethyl Ammonium Nitrate2018 | American Chemical Society
ArticlesIron promoted C3-H nitration of 2H-indazole: direct access to 3-nitro-2H-indazoles2018 | Royal Society of Chemistry- ArticlesBiosolvation Nature of Ionic Liquids: Molecular Dynamics Simulation of Methylated Nucleobases in Hydrated 1-Ethyl-3-methylimidazolium Acetate2018 | American Chemical Society
- ArticlesStructure and Dynamics of Hydroxyl-Functionalized Protic Ammonium Carboxylate Ionic Liquids2017 | American Chemical Society
- ArticlesProtic ammonium carboxylate ionic liquids: Insight into structure, dynamics and thermophysical properties by alkyl group functionalization2017 | Royal Society of Chemistry
ArticlesUltrafast Vibrational Spectroscopy of Aqueous Solution of Methylamine from First Principles MD Simulations2017 | Wiley-Blackwell- ArticlesTime-dependent vibrational spectral analysis of first principles trajectory of methylamine with wavelet transform2017 | Royal Society of Chemistry
ArticlesFormation of BH3 Adducts with Pyridine-2-Methylaminophosphine ligands: An experimental and computational study2016 | Springer India- ArticlesA delicate case of unidirectional proton transfer from water to an aromatic heterocyclic anion2016 | Royal Society of Chemistry
ArticlesProton transfer from water to anion: Free energy profile from first principles metadynamics simulations2016 | Elsevier B.V.- ArticlesHeavier group 2 metal complexes with a flexible scorpionate ligand based on 2-mercaptopyridine2015 | Royal Society of Chemistry
- ArticlesUnprecedented calcium metalla-macrocycle having phosphinoselenoic amide and diphenylphosphinate in the coordination sphere2014 | Wiley-VCH Verlag
