Artificial Intelligence: A Novel Approach for Drug Discovery.

Clicks: 326
ID: 2177
2019
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Abstract
Molecular dynamics (MD) simulations can mechanistically explain receptor function. However, the enormous data sets that they may imply can be a hurdle. Plante and colleagues (Molecules, 2019) recently described a machine learning approach to the analysis of MD simulations. The approach successfully classified ligands and identified functional receptor motifs and thus it seems promising for mechanism-based drug discovery.
Reference Key
daz2019artificialtrends Use this key to autocite in the manuscript while using SciMatic Manuscript Manager or Thesis Manager
Authors Díaz, Óscar;Dalton, James A R;Giraldo, Jesús;
Journal trends in pharmacological sciences
Year 2019
DOI
S0165-6147(19)30136-1
URL
Keywords Keywords not found

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