Fragment-centric topographic mapping method guides the understanding of ABCG2-inhibitor interactions

Understanding protein–ligand interactions is crucial to drug discovery and design. However, it would be extremely difficult for the proteins which only have one available apo structure but multiple binding sites. To address this constraint, a fragment-centric topographic mapping method (AlphaSpace s...

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Detalles Bibliográficos
Autores principales: Wu, Yao, Gao, Xin-Ying, Chen, Xin-Hui, Zhang, Shao-Long, Wang, Wen-Juan, Sheng, Xie-Huang, Chen, De-Zhan
Formato: Online Artículo Texto
Lenguaje:English
Publicado: The Royal Society of Chemistry 2019
Materias:
Chemistry
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9061187/
https://www.ncbi.nlm.nih.gov/pubmed/35521159
http://dx.doi.org/10.1039/c8ra09789e

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9061187/
https://www.ncbi.nlm.nih.gov/pubmed/35521159
http://dx.doi.org/10.1039/c8ra09789e

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