Sample interview questions: Have you used any chemoinformatics approaches for lead optimization in drug discovery projects?
Sample answer:
-
Used Quantitative Structure-Activity Relationship (QSAR) modeling to predict the biological activity of compounds. This approach involves developing mathematical models that relate the chemical structure of compounds to their biological activity. QSAR models can be used to identify lead compounds with the desired activity and to optimize the structure of lead compounds to improve their potency and selectivity.
-
Applied molecular docking to study the interactions between compounds and biological targets. Molecular docking is a computational technique that predicts the binding mode of a compound to a biological target. This information can be used to identify key interactions between the compound and the target, and to design compounds that have a higher affinity for the target.
-
Utilized virtual screening to identify potential lead compounds from large chemical libraries. Virtual screening is a computational technique that rapidly evaluates the potential biological activity of compounds in a chemical library. This approach can be used to identify lead compounds … Read full answer
Source: https://hireabo.com/job/5_2_14/Computational%20Chemist