Enthalpy–entropy compensation: the role of solvation
Abstract
Structural modifications to interacting systems frequently lead to changes in both the enthalpy (heat) and entropy of the process that compensate each other, so that the Gibbs free energy is little changed: a major barrier to the development of lead compounds in drug discovery. The conventional explanation for such enthalpy-entropy compensation (EEC) is that tighter contacts lead to a more negative enthalpy but increased molecular constraints,...
Paper Details
Title
Enthalpy–entropy compensation: the role of solvation
Published Date
Oct 28, 2016
Journal
Volume
46
Issue
4
Pages
301 - 308
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