Automated multi-objective reaction optimisation: which algorithm should I use?
Pia Müller, Adam D. Clayton, Jamie A. Manson, Samuel Riley, Oliver May, Norman Govan, Stuart Notman, Steven V. Ley, Thomas W. Chamberlain, Richard A. Bourne
Abstract
An open-source reaction simulator was designed to benchmark the performance of multi-objective optimisation algorithms using chemistry-inspired test problems, which was validated using an experimental self-optimisation platform.
Topics & Concepts
Benchmark (surveying)Computer scienceOpen sourceAlgorithmSoftwareProgramming languageGeodesyGeographyProcess Optimization and IntegrationInnovative Microfluidic and Catalytic Techniques InnovationAdvanced Multi-Objective Optimization Algorithms