Johanna Kleinekorte's repositories
millgas2what
Repository to the paper "What shall we do with steel mill off-gas: Polygeneration systems minimizing greenhouse gas emissions"
activity-browser
GUI for brightway2
Language:JavaScriptLGPL-3.0000
AspenPlus-Python-Interface
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
Language:Python000
botorch
Bayesian optimization in PyTorch
Language:PythonMIT000
data_efficient_grammar
[ICLR 2022] Data-Efficient Graph Grammar Learning for Molecular Generation
Language:Jupyter NotebookMIT000
feos-pcsaft
Implementation of the PC-SAFT equation of state and corresponding Helmholtz energy functional.
Language:RustNOASSERTION000