Protein–ligand binding with the coarse-grained Martini model
Protein–ligand binding with the coarse-grained Martini model
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Publisher
London: Nature Publishing Group UK
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English
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London: Nature Publishing Group UK
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The detailed understanding of the binding of small molecules to proteins is the key for the development of novel drugs or to increase the acceptance of substrates by enzymes. Nowadays, computer-aided design of protein–ligand binding is an important tool to accomplish this task. Current approaches typically rely on high-throughput docking essays or...
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Protein–ligand binding with the coarse-grained Martini model
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TN_cdi_doaj_primary_oai_doaj_org_article_6fb80fd1c6c248a096931d38d50177ec
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https://devfeature-collection.sl.nsw.gov.au/record/TN_cdi_doaj_primary_oai_doaj_org_article_6fb80fd1c6c248a096931d38d50177ec
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ISSN
2041-1723
E-ISSN
2041-1723
DOI
10.1038/s41467-020-17437-5
