Autocorrelation of molecular electrostatic potential surface properties combined with partial least squares analysis as new strategy for the prediction of the activity of human A(3) adenosine receptor antagonists.

Moro, Stefano

Autocorrelation of molecular electrostatic potential surface properties combined with partial least squares analysis as new strategy for the prediction of the activity of human A(3) adenosine receptor antagonists. [electronic resource] - Journal of medicinal chemistry Sep 2005 - 5698-704 p. digital

Publication Type: Journal Article; Research Support, Non-U.S. Gov't

0022-2623

10.1021/jm0502440 doi


Adenosine A3 Receptor Antagonists
Binding Sites
Databases, Factual
Humans
Least-Squares Analysis
Ligands
Models, Molecular
Quantitative Structure-Activity Relationship
Receptor, Adenosine A3--chemistry
Static Electricity
Surface Properties