(673g) An Adaptive Sampling Surrogate Model for Mixing Time Prediction and Mixing Characterization
AIChE Annual Meeting
2022
2022 Annual Meeting
Pharmaceutical Discovery, Development and Manufacturing Forum
Modeling solubility, dissolution, permeability and drug delivery
Thursday, November 17, 2022 - 5:35pm to 6:00pm
Characterization of process tanks to determine effective mixing and homogenous conditions is a time consuming and cost intensive effort. Therefore, we have developed a comprehensive in-silico model to predict mixing time based on tank specifications, agitation rate and mixture physical properties. Our model is developed based a Computational Fluid Dynamics (CFD) model which is validated in mixing analysis of biopharma mixing vessels. The CFD model is integrated into a four-variables surrogate model in which an adaptive sampling method is applied. Our surrogate model is capable of predicting mixing time and mixing characterization with less than 25% error with only 60 model training samples. The developed surrogate model is available in as a web interface for use by domain experts.