Revealing noncovalent interactions

Molecular structure does not easily identify the intricate noncovalent interactions that govern many areas of biology and chemistry, including design of new materials and drugs. We develop an approach to detect noncovalent interactions in real space, based on the electron density and its derivatives...

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Vydané v:	Journal of the American Chemical Society Ročník 132; číslo 18; s. 6498
Hlavní autori:	Johnson, Erin R, Keinan, Shahar, Mori-Sánchez, Paula, Contreras-García, Julia, Cohen, Aron J, Yang, Weitao
Médium:	Journal Article
Jazyk:	English
Vydavateľské údaje:	United States 12.05.2010
Predmet:	Base Sequence DNA - chemistry DNA - genetics DNA - metabolism Electrons Hydrogen Bonding Models, Chemical Models, Molecular Molecular Conformation Proteins - chemistry Proteins - metabolism Quantum Theory
ISSN:	1520-5126, 1520-5126
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