Predicting Drug Degradation Using Biovia Materials Studio and Biovia Pipeline Pilot
Predicting Drug Degradation Using Biovia Materials Studio and Biovia Pipeline Pilot
3 Pagesof APIs commonly reported in the literature: hydrolysis and oxidation by molecular oxygen (a.k.a. Autoxidation). Molecular modelling tools are routinely used at the preformulation stage to compute key properties of the APIs. In particular, quantum mechanical tools based on the Density Functional Theory (DFT) are amongst the most widespread due to their high accuracy for a relatively low computational cost. A previous study on drug substanc
