Model-based evaluation and data requirements for parallel kinetic experimentation and data-driven reaction identification and optimization
Nathan Jiscoot, Evgeny A. Uslamin, Evgeny A. Pidko
Abstract
Chemfit uses kinetic data to facilitate the discovery of rates within chemical models, the quantification of chemical model accuracy, and the exploration of data quality and quantity requirements needed for reliable kinetic parameter discovery.
Topics & Concepts
Identification (biology)Kinetic energyComputer scienceExperimental dataData miningMathematicsStatisticsPhysicsBiologyQuantum mechanicsBotanyMachine Learning in Materials ScienceComputational Drug Discovery MethodsInnovative Microfluidic and Catalytic Techniques Innovation