Scalable Bayesian Optimization Accelerates Process Optimization of Penicillin Production

1 code implementation • NeurIPS Workshop AI4Scien 2021 • Qiaohao Liang, Lipeng Lai

While Bayesian Optimization (BO) has emerged as sample-efficient optimization method for accelerating drug discovery, it has rarely been applied to the process optimization of pharmaceutical manufacturing, which traditionally has relied on human-intuition, along with trial-and-error and slow cycles of learning.

Bayesian Optimization Drug Discovery