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Binding site matching in rational drug design: algorithms and applications

Interactions between proteins and small molecules are critical for biological functions. These interactions often occur in small cavities within protein structures, known as ligand-binding pockets. Understanding the physicochemical qualities of binding pockets is essential to improve not only our ba...

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Detalhes bibliográficos
Publicado no:Brief Bioinform
Main Authors: Naderi, Misagh, Lemoine, Jeffrey Mitchell, Govindaraj, Rajiv Gandhi, Kana, Omar Zade, Feinstein, Wei Pan, Brylinski, Michal
Formato: Artigo
Idioma:Inglês
Publicado em: Oxford University Press 2018
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC6954434/
https://ncbi.nlm.nih.gov/pubmed/30169563
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1093/bib/bby078
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