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Shape-Restrained Modeling of Protein–Small-Molecule Complexes with High Ambiguity Driven DOCKing
[Image: see text] Small-molecule docking remains one of the most valuable computational techniques for the structure prediction of protein–small-molecule complexes. It allows us to study the interactions between compounds and the protein receptors they target at atomic detail in a timely and efficie...
Autores principales: | , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
American Chemical Society
2021
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Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8479858/ https://www.ncbi.nlm.nih.gov/pubmed/34436890 http://dx.doi.org/10.1021/acs.jcim.1c00796 |