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Virtual Screening and Design with Machine Intelligence Applied to Pim‐1 Kinase Inhibitors

Ligand‐based virtual screening of large compound collections, combined with fast bioactivity determination, facilitate the discovery of bioactive molecules with desired properties. Here, chemical similarity based machine learning and label‐free differential scanning fluorimetry were used to rapidly...

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Detalhes bibliográficos
Publicado no:Mol Inform
Principais autores: Schneider, Petra, Welin, Martin, Svensson, Bo, Walse, Björn, Schneider, Gisbert
Formato: Artigo
Idioma:Inglês
Publicado em: John Wiley and Sons Inc. 2020
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC7539333/
https://ncbi.nlm.nih.gov/pubmed/33448694
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1002/minf.202000109
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