Author: Iurii Sushko

abdel – Public QSAR framework for modeling PK/PD parameters

May 18, 2011 - Poster
The Online Chemical Modeling Environment is a web-based platform that aims to automate and simplify the typical steps required for QSAR modeling. The platform consists of two major subsys…

A comparison of different QSAR approaches to modeling CYP450 1A2 inhibition

May 20, 2011 - Publication
Prediction of CYP450 inhibition activity of small molecules poses an important task due to high risk of drug–drug interactions. CYP1A2 is an important member of CYP450 superfamily and a…