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Theoretical Model of EphA2-Ephrin A1 Inhibition

This work aims at the theoretical description of EphA2-ephrin A1 inhibition by small molecules. Recently proposed ab initio-based scoring models, comprising long-range components of interaction energy, is tested on lithocholic acid class inhibitors of this protein–protein interaction (PPI) against c...

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Detalhes bibliográficos
Publicado no:Molecules
Main Authors: Jedwabny, Wiktoria, Lodola, Alessio, Dyguda-Kazimierowicz, Edyta
Formato: Artigo
Idioma:Inglês
Publicado em: MDPI 2018
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC6099714/
https://ncbi.nlm.nih.gov/pubmed/29997324
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.3390/molecules23071688
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