Awesome machine learning for combinatorial optimization papers.

Official repository for the Boltz biomolecular interaction models

Open-Source Lyophilization Process Optimization Tool

Julia version of LyoPRONTO.

Code Repository for Federated Learning in Chemical Engineering: A Tutorial on a Framework for Privacy-Preserving Collaboration Across Distributed Data Sources. The paper can be found here:

An example starter repo for Python projects

Run computational experiments using marimo notebooks

The Julia Programming Language

This is the repository for the Data Science in Chemical Engineering course CHE597 at Purdue University

A tool to optimize real world problems

QUBO.jl Notebooks

Examples and tutorials for how to use CUDA-Q.

A numerical platform for the digital design of pharmaceutical processes