Pinned Repositories
ac-bo-hackathon.github.io
best_batchers
Bayesian Optimization Hackathon for Chemistry and Materials, Project 15: Adaptive Batch Sizes for Bayesian Optimization of Reaction Yield
EML
Encrypted machine learning of molecular quantum properties
geometric-geniuses
Contribution for 24' LLM Hackathon for Applications in Materials and Chemistry
qmlnet
rules_of_acquisition
Bayesian Optimization made simple. Name derived from Star Trek universe, the "Rules of Acquisition" are a collection of sacred business proverbs of the ultra-capitalist race known as the Ferengi.
sklearn_reg
janweinreich's Repositories
janweinreich/best_batchers
Bayesian Optimization Hackathon for Chemistry and Materials, Project 15: Adaptive Batch Sizes for Bayesian Optimization of Reaction Yield
janweinreich/EML
Encrypted machine learning of molecular quantum properties
janweinreich/geometric-geniuses
Contribution for 24' LLM Hackathon for Applications in Materials and Chemistry
janweinreich/rules_of_acquisition
Bayesian Optimization made simple. Name derived from Star Trek universe, the "Rules of Acquisition" are a collection of sacred business proverbs of the ultra-capitalist race known as the Ferengi.
janweinreich/qmlnet
janweinreich/sklearn_reg
janweinreich/ac-bo-hackathon.github.io
janweinreich/Buttons
How to create Markdown buttons.
janweinreich/grid
janweinreich/janweinreich
Config files for my GitHub profile.
janweinreich/molzip
The gzip classification method implemented for molecule classification.
janweinreich/molzip2
janweinreich/openmm-tutorials
Quickstart Python tutorials helping molecular dynamics practitioners get up to speed with OpenMM
janweinreich/OpenMMSolvation
janweinreich/stoch_proc