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Transferability of Geometric Patterns from Protein Self-Interactions to Protein-Ligand Interactions

There is significant interest in developing machine learning methods to model protein-ligand interactions but a scarcity of experimentally resolved protein-ligand structures to learn from. Protein self-contacts are a much larger source of structural data that could be leveraged, but currently it is...

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Detalles Bibliográficos
Autores principales: Koehl, Antoine, Jagota, Milind, Erdmann-Pham, Dan D., Fung, Alexander, Song, Yun S.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: 2022
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8669734/
https://www.ncbi.nlm.nih.gov/pubmed/34890133