| Article ID | Journal | Published Year | Pages | File Type |
|---|---|---|---|---|
| 1179564 | Chemometrics and Intelligent Laboratory Systems | 2012 | 5 Pages |
Abstract
⺠The bioactivities of non-peptide HIV-1 protease inhibitors were accurately modeled by MIA-QSAR. ⺠Docking studies revealed the important interactions between ligand and enzyme. ⺠Preliminary ADME evaluation was performed for selected compounds and new molecules. ⺠Novel congeners with improved bioactivities and ADME parameters were proposed.
Keywords
Related Topics
Physical Sciences and Engineering
Chemistry
Analytical Chemistry
Authors
Omar Deeb, Elaine F.F. da Cunha, Rodrigo A. Cormanich, Teodorico C. Ramalho, Matheus P. Freitas,