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Revealing Non-Covalent Interactions

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

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Detalhes bibliográficos
Main Authors: Johnson, Erin R., Keinan, Shahar, Mori-Sánchez, Paula, Contreras-García, Julia, Cohen, Aron J., Yang, Weitao
Formato: Artigo
Idioma:Inglês
Publicado em: 2010
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC2864795/
https://ncbi.nlm.nih.gov/pubmed/20394428
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/ja100936w
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