Concepedia

Spectroscopic characterization of 4-[2-(5-Ethylpyridin-2-yl)ethoxy]benzaldehyde oxime and investigation of its reactive properties by DFT calculations and molecular dynamics simulations

K. Jalaja, Y. Sheena Mary, C. Yohannan Panicker, Stevan Armaković, Sanja J. Armaković, B.K. Sagar, M. Girisha, H.S. Yathirajan, Christian Van Alsenoy

Journal of Molecular Structure · 2016 · 29 citations · 54 references

DOI

Concepts

References

54

AutoDock Vina: Improving the speed and accuracy of docking with a new scoring function, efficient optimization, and multithreading

Oleg Trott, Arthur J. Olson · Journal of Computational Chemistry · 2009 · 35.1K citations · Full text

Spectrometric identification of organic compounds

Robert M. Silverstein, G. Clayton Bassler · Journal of Chemical Education · 1962 · 14.2K citations

, , +17

Revealing Noncovalent Interactions

Erin R. Johnson, Shahar Keinan, Paula Mori‐Sánchez et al. · Journal of the American Chemical Society · 2010 · 8.9K citations

, , +11

Spectrometric Identification of Organic Compounds

Gary W. Small · Vibrational Spectroscopy · 1992 · 2.8K citations

, , +6

1,3‐Dipolar Cycloadditions. Past and Future

Rolf Huisgen · Angewandte Chemie International Edition in English · 1963 · 2.8K citations

, , +12