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Data of small peptides in SMILES and three-dimensional formats for virtual screening campaigns

The data presented in this article are structures of dipeptides, tripeptides and tetrapeptides constructed from all possible combinations of 20 natural and common amino acids. In total, the data contains 168400 peptides. The structures are available in their simplified molecular-input line-entry sys...

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Detalhes bibliográficos
Publicado no:Data Brief
Main Authors: Prasasty, Vivitri Dewi, Istyastono, Enade Perdana
Formato: Artigo
Idioma:Inglês
Publicado em: Elsevier 2019
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC6806445/
https://ncbi.nlm.nih.gov/pubmed/31656840
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1016/j.dib.2019.104607
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