Differentiable Reacting Flow Modeling Software

Atomic graph models for molecules and crystals in Julia

A Julian abstract interface for atomic structures.

Nucleic and amino acid primitive types

Simulation of Brownian-Based Stochastic Processes

Chemical reaction network and systems biology interface for scientific machine learning (SciML). High performance, GPU-parallelized, and O(1) solvers in open source software.

Julia bindings to chemfiles

Simulation, Bayesian inference and Bayesian model selection for chemical kinetics in Julia

Interface package for featurizing atomic structures

A collection of tools for chemometrics and machine learning written in Julia.

Clapeyron provides a framework for the development and use of fluid-thermodynamic models, including SAFT, cubic, activity, multi-parameter, and COSMO-SAC.

Functions from EDX course "AA432x Composite Materials Overview for Engineers"

Efficient calculation of Clifford circuits in Julia.

A Julia wrapper for CoolProp, offering access to thermodynamic properties for fluids and mixtures.

Julia tools for reading Crystallographic Information Framework (CIF) files and dictionaries

A Julia package for sampling the dimer model on a grid

Implement Dynamic Time Warping for sequence alignment in Julia.

Efficient lattice simulation algorithms - a Julia library

Fermi quantum chemistry program

Artificial Hydrocarbon Networks (AHNs) in Julia.

Julia Library for Interatomic Potentials

A Lattice Library for Julia

Tools for WGBS Methylation analysis

Graph-based molecule modeling toolkit for cheminformatics

Molecular simulation in Julia

Tools to generate and study moment equations for any chemical reaction network using various moment closure approximations

OpenSMILES parser in Julia

Periodic Table for Julians! :fire:

High-performance simulations of the Porous Electrode Theory for Li-ion batteries

Collection of fundamental physical constants with uncertainties. It supports arbitrary-precision constants

Julia package towards classical molecular modeling of nanoporous materials

Thermodynamic properties of moist air in Julia

Generic lab tools in Julia

Unitary and Lindbladian evolution in Julia

A workbench for Quantum Chemistry and Quantum Physics in Julia

The amazing Reaction Mechanism Simulator for simulating large chemical kinetic mechanisms

Solid state detector field and charge drift simulation in Julia

Coherence/phase-locking statistics in Julia