Glowing Molecule

Explore the relationship between properties and structure

The Glowing Molecule visualisation highlights the regions of your compounds which may have the greatest influence on predicted properties. This guides the optimisation of compounds with improved properties.

  • Edit your compound: interactively explore the impact of structural changes on a compound's predicted properties and overall balance of properties you require.
  • Link structure and properties: easily visualise the regions of your molecules with the greatest impact on a property
  • Interpret black-box models: such as those created with advanced, non-linear techniques
The Glowing Molecule is gnerated by models provided by StarDrop's ADME QSAR and Derek Nexus modules or those built with the Auto-Modeller module.

If you would like to know more about the Glowing Molecule, take a look at what other people have been asking in the FAQs.

To find out more about StarDrop and the Glowing Molecule, to arrange an online demonstration or to try StarDrop for yourself, please contact us.

StarDrop - Glowing Molecule
"Take a look at Matt Segall's poster explaining the Glowing Molecule called "Opening the 'Black Box': Interpreting in Silico Models to Guide Compound Design"."
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