SAR & QSAR

The ultimate objective of many computational modeling studies is to identify compounds that could potentially become new drugs. With appropriate molecular descriptors, the large quantity of relatively easily available data inherent in chemical libraries can be mined, analyzed and used to develop QSAR models that enable you to select compounds that can become drug leads. Using the Pipeline Pilot Platform, QSAR models can easily be deployed to and shared among large groups of chemists. Accelrys offers SAR, QSAR, and Library Design software solutions that allow you to describe billions of structural features present in molecules using Extended Connectivity Fingerprint (ECFP) descriptors; access traditional descriptors for basic chemical features, physical properties, ADME characteristics, and experimental data; and much more

Read more about Accelrys' SAR, QSAR, and Library Design software and service solutions >>>