Ensemble Generation and the Influence of Protein Flexibility on Geometric Tunnel Prediction in Cytochrome P450 Enzymes

Computational prediction of ligand entry and egress paths in proteins has become an emerging topic in computational biology and has proven useful in fields such as protein engineering and drug design. Geometric tunnel prediction programs, such as Caver3.0 and MolAxis, are computationally efficient m...

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Detalles Bibliográficos
Autores principales: Kingsley, Laura J., Lill, Markus A.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Public Library of Science 2014
Materias:
Research Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4067289/
https://www.ncbi.nlm.nih.gov/pubmed/24956479
http://dx.doi.org/10.1371/journal.pone.0099408

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4067289/
https://www.ncbi.nlm.nih.gov/pubmed/24956479
http://dx.doi.org/10.1371/journal.pone.0099408

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