re-TAMD: exploring interactions between H3 peptide and YEATS domain using enhanced sampling

BACKGROUND: Analysis of preferred binding regions of a ligand on a protein is important for detecting cryptic binding pockets and improving the ligand selectivity. RESULT: The enhanced sampling approach TAMD has been adapted to allow a ligand to unbind from its native binding site and explore the pr...

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Detalles Bibliográficos
Autores principales: Lamothe, Gilles, Malliavin, Thérèse E.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: BioMed Central 2018
Materias:
Methodology Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5883362/
https://www.ncbi.nlm.nih.gov/pubmed/29615024
http://dx.doi.org/10.1186/s12900-018-0083-6

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5883362/
https://www.ncbi.nlm.nih.gov/pubmed/29615024
http://dx.doi.org/10.1186/s12900-018-0083-6

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