chemical-reaction-networks
Chemical reaction networks in JAX: GPU-parallel stochastic simulations.
General purpose tools for high-throughput catalysis.
Biological Stochastic Simulation of Single Cell Reactions and Parameter Estimation
Automated creation and manipulation of chemical reaction networks (CRNs) in heterogeneous catalysis, powered by state-of-the-art ML evaluators and Julia-solvers for microkinetic modelling.
SageMath package for (chemical) reaction networks using sign vector conditions
A Query-Based Language for Chemical Reaction Networks
