Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Cited by
15 articles.
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1. Vibrational analysis, DFT computations of spectroscopic, non-covalent analysis with molecular docking and dynamic simulation of 2-amino-4, 6-dimethyl pyrimidine benzoic acid;Journal of Molecular Structure;2024-12
2. Leveraging the properties of pyridine derivatives using DFT analysis to achieve breakthroughs in supercapacitance advancements;Ionics;2024-08-02
3. Synthesis, spectroscopic analysis (FT-IR, FT-Raman, UV, NMR), non-covalent interactions (RDG, IGM) and dynamic simulation on Bis(8‑hydroxy quinoline) salicylate salicylic acid;Journal of Molecular Structure;2024-08
4. Experimental, DFT and MD simulation combined studies for the competitive adsorption of anionic and cationic dyes on activated carbon in an aqueous medium;Journal of Molecular Structure;2024-08
5. Theoretical spectroscopic electronic elucidation with polar and non-polar solvents (IEFPCM model), molecular docking and molecular dynamic studies on bendiocarb -antiallergic drug agent;Journal of Molecular Liquids;2024-06