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Exploring Conformational Preferences of Leu-enkephalin Using the Conformational Search and Double-Hybrid DFT Energy Calculations

[Image: see text] The conformational preferences of Leu-enkephalin (Leu-Enk) were explored by the conformational search and density functional theory (DFT) calculations. By a combination of low-energy conformers of each residue, the initial structures of the neutral Leu-Enk were generated and optimi...

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Detalles Bibliográficos
Autores principales:	Park, Hae Sook, Byun, Byung Jin, Kang, Young Kee
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	American Chemical Society 2022
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9366962/ https://www.ncbi.nlm.nih.gov/pubmed/35967045 http://dx.doi.org/10.1021/acsomega.2c03942

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