A General Treatment of Solvent Effects Based on Screened Coulomb Potentials

2000 ◽  
Vol 104 (27) ◽  
pp. 6478-6489 ◽  
Author(s):  
Sergio A. Hassan ◽  
Frank Guarnieri ◽  
Ernest L. Mehler
Keyword(s):  
Solvent Effects ◽  
General Treatment ◽  
Screened Coulomb Potentials ◽  
Coulomb Potentials

scholarly journals Functional group interaction profiles: a general treatment of solvent effects on non-covalent interactions

2020 ◽  
Vol 11 (17) ◽  
pp. 4456-4466 ◽  
Author(s):  
Mark D. Driver ◽  
Mark J. Williamson ◽  
Joanne L. Cook ◽  
Christopher A. Hunter
Keyword(s):  
Free Energy ◽  
Solvent Effects ◽  
Functional Group ◽  
Group Interaction ◽  
General Treatment ◽  
Effect Of Solvent ◽  
Non Covalent Interactions ◽  
Covalent Interactions ◽  
Quantitative Tool

Functional group interaction profiles are a quantitative tool for predicting the effect of solvent on the free energy changes associated with non-covalent interactions.

Sign in / Sign up

Export Citation Format

Share Document