Knowledge Base

Article ID: 1015 - Last Modified: December 4, 2010

What are the units of Emodel and GlideScore?

The units of GlideScore are kcal/mol. Both SP and XP GlideScore have been calibrated to reproduce certain experimental binding affinities. The individual terms (Emodel, Ecoul, and so on) in the GlideScore formula are parametrized in this calibration: these terms should therefore not be interpreted as quantitative calculations of energies.

Keywords: Glide, units

Back to Search Results

Was this information helpful?

What can we do to improve this information?


To ask a question or get help, please submit a support ticket or email us at help@schrodinger.com.
Knowledge Base Search

Type the words or phrases on which you would like to search, or click here to view a list of all
Knowledge Base articles