Name: Johanna Kleinekorte
Type: User
Company: Evonik Operations GmbH
Bio: Interested in Cheminformatics, Bayesian Optimization, Material Discovery, and sustainability topics @evonik-dev @experimental-design
Location: Marl
Blog: https://www.linkedin.com/in/johanna-kleinekorte-613997123
Johanna Kleinekorte's Projects
GUI for brightway2
Aspen Plus - Python interface which acts as an API to automate the design synthsis. It includes all variables for RADFRAC, DSTWU, Flash2, RYield, RPlug, RCSTR, Heater, Mixer, Splitter. It includes a optimization library implementation from scipy
Bayesian optimization in PyTorch
[ICLR 2022] Data-Efficient Graph Grammar Learning for Molecular Generation
Implementation of the PC-SAFT equation of state and corresponding Helmholtz energy functional.
Repository to the paper "What shall we do with steel mill off-gas: Polygeneration systems minimizing greenhouse gas emissions"