Concepedia

Molecular structure, optoelectronic properties, spectroscopic (FT-IR, FT-Raman and UV–Vis), H-BDE, NBO and drug likeness investigations on 7, 8-benzocoumarin-4-acetic acid (7BAA)

Seema S. Khemalapure, Vinay S. Katti, Chidanandayya S. Hiremath, Mahantesha Basanagouda, Sudhir M. Hiremath, Sanja J. Armaković, Stevan Armaković

Journal of Molecular Structure · 2019 · 34 citations · 42 references

DOI

Concepts

References

42

Spectrometric identification of organic compounds

Robert M. Silverstein, G. Clayton Bassler · Journal of Chemical Education · 1962 · 14.3K citations

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Experimental and computational approaches to estimate solubility and permeability in drug discovery and development settings

Christopher A. Lipinski, Franco Lombardo, Beryl W. Dominy et al. · Advanced Drug Delivery Reviews · 1997 · 11.2K citations

, , +16

Density-Functional Theory for Time-Dependent Systems

Erich Runge, E. K. U. Gross · Physical Review Letters · 1984 · 8.8K citations

, , +14

Lead- and drug-like compounds: the rule-of-five revolution

Christopher A. Lipinski · Drug Discovery Today Technologies · 2004 · 6.1K citations

, , +14

Electron transfer reactions in chemistry. Theory and experiment

R. A. Marcus · Reviews of Modern Physics · 1993 · 3.6K citations · Full text

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