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TransportTools: a library for high-throughput analyses of internal voids in biomolecules and ligand transport through them
SUMMARY: Information regarding pathways through voids in biomolecules and their roles in ligand transport is critical to our understanding of the function of many biomolecules. Recently, the advent of high-throughput molecular dynamics simulations has enabled the study of these pathways, and of rare...
Autores principales: | , , , , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
Oxford University Press
2021
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8896600/ https://www.ncbi.nlm.nih.gov/pubmed/34971366 http://dx.doi.org/10.1093/bioinformatics/btab872 |