Article ID | Journal | Published Year | Pages | File Type |
---|---|---|---|---|
9591226 | Journal of Molecular Structure: THEOCHEM | 2005 | 4 Pages |
Abstract
A functional virtual screen was developed using FlexX-Pharm/ChemScore that separates ligands taking advantage of the different binding modes between estrogen receptor alpha agonists and antagonists. Increased performance of FlexX-Pharm over FlexX was also demonstrated on the estrogen receptor.
Keywords
Related Topics
Physical Sciences and Engineering
Chemistry
Physical and Theoretical Chemistry
Authors
István Virág, TÃmea Polgár, György M. Keserű,